N-Cyclohexyl-2-benzothiazol-amine (CED0055441)

Record Information
Version1.0
Creation Date2026-04-02 23:19:30 UTC
Update Date2026-08-19 00:35:06 UTC
SynCED IDCED0055441
Secondary Accession Numbers
  • CHEM059083
Identification
Common NameN-Cyclohexyl-2-benzothiazol-amine
ClassSmall Molecule
Description
N-Cyclohexyl-2-benzothiazol-amine belongs to the benzothiazoles, a class of organoheterocyclic compounds within the organic compounds. This compound has the formula C13H16N2S1 and an average molecular weight of 232.35 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC13H16N2S1
Average Molecular Mass232.350 g/mol
Monoisotopic Mass232.103 g/mol
CAS Registry Number28291-75-0
IUPAC NameNot Available
Traditional NameNot Available
SMILESC1CCC(CC1)NC1=NC2=C(S1)C=CC=C2
InChI IdentifierInChI=1S/C13H16N2S/c1-2-6-10(7-3-1)14-13-15-11-8-4-5-9-12(11)16-13/h4-5,8-10H,1-3,6-7H2,(H,14,15)
InChI KeyUPWPIFMHSFSVLE-UHFFFAOYSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Toxicity Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
296.0 Log mg/kg [170:530]RatLD50oralpredictedNot AvailableNot Available
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Health Effects
Health EffectRelationshipDirectionDescriptionReference
Exposure Sources
Source IDSourceSectorReference
CEDs000511Conductors Or Conductive Bodies Characterised By The Conductive Materials?Conductors, or conductive bodies, are materials that allow the flow of electrical current, typically made from metals such as copper, aluminum, or silver.Electrical & Electronic EquipmentPubChem
CEDs03291Tire RubberAutomotive & urban infrastructurePMC8818004
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Neuronal calcium sensor 1 structureClick to view 3D structureNeuronal calcium sensor 1P62166HumansPredicted (SEA)
Prediction Confidence Score
0.396
Applicability Domain
0.396
Statistical Significance
1.50e-04
Supporting Reference Compounds
1
E-value
1.16774
Frequenin-2 structureClick to view 3D structureFrequenin-2Q9VWX8Drosophila melanogasterPredicted (SEA)
Prediction Confidence Score
0.396
Applicability Domain
0.396
Statistical Significance
1.50e-04
Supporting Reference Compounds
1
E-value
1.16774
Tyrosine-protein kinase Lck structureClick to view 3D structureTyrosine-protein kinase LckP06239HumansPredicted (SEA)
Prediction Confidence Score
0.348
Applicability Domain
0.431
Statistical Significance
0.0558
Supporting Reference Compounds
1130
E-value
434.71
Aurora kinase B structureClick to view 3D structureAurora kinase BQ96GD4HumansPredicted (SEA)
Prediction Confidence Score
0.348
Applicability Domain
0.431
Statistical Significance
0.0449
Supporting Reference Compounds
1017
E-value
349.465
Tyrosine-protein kinase ITK/TSK structureClick to view 3D structureTyrosine-protein kinase ITK/TSKQ08881HumansPredicted (SEA)
Prediction Confidence Score
0.338
Applicability Domain
0.431
Statistical Significance
0.0391
Supporting Reference Compounds
570
E-value
304.313
Receptor-type tyrosine-protein kinase FLT3 structureClick to view 3D structureReceptor-type tyrosine-protein kinase FLT3P36888HumansPredicted (SEA)
Prediction Confidence Score
0.325
Applicability Domain
0.38
Statistical Significance
0.083
Supporting Reference Compounds
1274
E-value
646.304
Macrophage colony-stimulating factor 1 receptor structureClick to view 3D structureMacrophage colony-stimulating factor 1 receptorP07333HumansPredicted (SEA)
Prediction Confidence Score
0.325
Applicability Domain
0.38
Statistical Significance
0.0611
Supporting Reference Compounds
833
E-value
475.347
D(3) dopamine receptor structureClick to view 3D structureD(3) dopamine receptorP35462HumansPredicted (SEA)
Prediction Confidence Score
0.324
Applicability Domain
0.395
Statistical Significance
0.0445
Supporting Reference Compounds
861
E-value
346.195
Glycylpeptide N-tetradecanoyltransferase structureClick to view 3D structureGlycylpeptide N-tetradecanoyltransferaseP30418YeastPredicted (SEA)
Prediction Confidence Score
0.324
Applicability Domain
0.324
Statistical Significance
6.20e-04
Supporting Reference Compounds
1
E-value
4.82665
D(2) dopamine receptor structureClick to view 3D structureD(2) dopamine receptorP14416HumansPredicted (SEA)
Prediction Confidence Score
0.322
Applicability Domain
0.395
Statistical Significance
0.0594
Supporting Reference Compounds
1103
E-value
462.191
Glycogen synthase kinase-3 beta structureClick to view 3D structureGlycogen synthase kinase-3 betaP49841HumansPredicted (SEA)
Prediction Confidence Score
0.321
Applicability Domain
0.38
Statistical Significance
0.0837
Supporting Reference Compounds
1157
E-value
651.364
Serine/threonine-protein kinase pim-1 structureClick to view 3D structureSerine/threonine-protein kinase pim-1P11309HumansPredicted (SEA)
Prediction Confidence Score
0.321
Applicability Domain
0.38
Statistical Significance
0.0676
Supporting Reference Compounds
967
E-value
526.261
Tyrosine-protein kinase BTK structureClick to view 3D structureTyrosine-protein kinase BTKQ06187HumansPredicted (SEA)
Prediction Confidence Score
0.319
Applicability Domain
0.38
Statistical Significance
0.0748
Supporting Reference Compounds
798
E-value
582.156
Fibroblast growth factor receptor 1 structureClick to view 3D structureFibroblast growth factor receptor 1P11362HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0752
Supporting Reference Compounds
1010
E-value
585.66
Tyrosine-protein kinase JAK3 structureClick to view 3D structureTyrosine-protein kinase JAK3P52333HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0825
Supporting Reference Compounds
961
E-value
642.334
Vascular endothelial growth factor receptor 1 structureClick to view 3D structureVascular endothelial growth factor receptor 1P17948HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0606
Supporting Reference Compounds
711
E-value
472.156
ALK tyrosine kinase receptor structureClick to view 3D structureALK tyrosine kinase receptorQ9UM73HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0593
Supporting Reference Compounds
708
E-value
461.568
Proto-oncogene tyrosine-protein kinase receptor Ret structureClick to view 3D structureProto-oncogene tyrosine-protein kinase receptor RetP07949HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0684
Supporting Reference Compounds
764
E-value
532.567
Hepatocyte growth factor receptor structureClick to view 3D structureHepatocyte growth factor receptorP08581HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0688
Supporting Reference Compounds
934
E-value
535.68
Vascular endothelial growth factor receptor 2 structureClick to view 3D structureVascular endothelial growth factor receptor 2P35968HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.1057
Supporting Reference Compounds
1660
E-value
822.633
Mitogen-activated protein kinase kinase kinase kinase 4 structureClick to view 3D structureMitogen-activated protein kinase kinase kinase kinase 4O95819HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0589
Supporting Reference Compounds
714
E-value
458.765
Insulin-like growth factor 1 receptor structureClick to view 3D structureInsulin-like growth factor 1 receptorP08069HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0675
Supporting Reference Compounds
785
E-value
525.404
Tyrosine-protein kinase JAK2 structureClick to view 3D structureTyrosine-protein kinase JAK2O60674HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0853
Supporting Reference Compounds
1022
E-value
664.054
Serine/threonine-protein kinase Chk1 structureClick to view 3D structureSerine/threonine-protein kinase Chk1O14757HumansPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.38
Statistical Significance
0.0609
Supporting Reference Compounds
807
E-value
473.79
Cyclin-dependent kinase 5 structureClick to view 3D structureCyclin-dependent kinase 5Q00535HumansPredicted (SEA)
Prediction Confidence Score
0.312
Applicability Domain
0.38
Statistical Significance
0.0688
Supporting Reference Compounds
779
E-value
535.525
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available