N-phenyl-4,5-dihydro-1,3-thiazol-2-amine (CED0220113)

Record Information
Version1.0
Creation Date2026-08-25 07:41:48 UTC
Update Date2026-08-25 07:41:48 UTC
SynCED IDCED0220113
Secondary Accession Numbers
  • CHEM261588
Identification
Common NameN-phenyl-4,5-dihydro-1,3-thiazol-2-amine
ClassSmall Molecule
Description
N-phenyl-4,5-dihydro-1,3-thiazol-2-amine belongs to the aniline and substituted anilines, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the chemical formula C9H10N2S and an average molecular weight of 178.26 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC9H10N2S
Average Molecular Mass178.260 g/mol
Monoisotopic Mass178.056 g/mol
CAS Registry Number1009-70-7
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C9H10N2S/c1-2-4-8(5-3-1)11-9-10-6-7-12-9/h1-5H,6-7H2,(H,10,11)
InChI KeyNNRDYOXKIWFNPP-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
210.0 Log mg/kg [120:370]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 EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
CEDs000563Soap Detergents?Soap detergents are synthetic surfactants designed to enhance the cleaning efficacy of water by reducing surface tension, allowing for better interaction with dirt and grease.Household cleaning & consumer productsNot Available
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Protein RecA structureClick to view 3D structureProtein RecAP9WHJ3Mycobacterium tuberculosisPredicted (SEA)
Prediction Confidence Score
0.277
Applicability Domain
0.293 Low confidence
Statistical Significance
0.0308
Supporting Reference Compounds
296
E-value
239.464
Click to view 3D structureVoltage-gated inwardly rectifying potassium channel KCNH3Q9ULD8HumansPredicted (SEA)
Prediction Confidence Score
0.273
Applicability Domain
0.273 Low confidence
Statistical Significance
0.0024
Supporting Reference Compounds
1
E-value
19.0731
Epidermal growth factor receptor structureClick to view 3D structureEpidermal growth factor receptorP00533HumansPredicted (SEA)
Prediction Confidence Score
0.269
Applicability Domain
0.308
Statistical Significance
0.2647
Supporting Reference Compounds
1301
E-value
2060.44
Prostaglandin G/H synthase 2 structureClick to view 3D structureProstaglandin G/H synthase 2P35354HumansPredicted (SEA)
Prediction Confidence Score
0.266
Applicability Domain
0.407
Statistical Significance
0.0478
Supporting Reference Compounds
201
E-value
372.119
Serine/threonine-protein kinase PLK3 structureClick to view 3D structureSerine/threonine-protein kinase PLK3Q9H4B4HumansPredicted (SEA)
Prediction Confidence Score
0.264
Applicability Domain
0.342
Statistical Significance
0.176
Supporting Reference Compounds
561
E-value
1369.99
Casein kinase II subunit alpha structureClick to view 3D structureCasein kinase II subunit alphaP68400HumansPredicted (SEA)
Prediction Confidence Score
0.26
Applicability Domain
0.342
Statistical Significance
0.2104
Supporting Reference Compounds
593
E-value
1637.95
Sodium-dependent noradrenaline transporter structureClick to view 3D structureSodium-dependent noradrenaline transporterP23975HumansPredicted (SEA)
Prediction Confidence Score
0.259
Applicability Domain
0.407
Statistical Significance
0.1176
Supporting Reference Compounds
451
E-value
915.585
Cyclin-dependent kinase 2 structureClick to view 3D structureCyclin-dependent kinase 2P24941HumansPredicted (SEA)
Prediction Confidence Score
0.255
Applicability Domain
0.316
Statistical Significance
0.3244
Supporting Reference Compounds
1029
E-value
2525.58
Dual specificity tyrosine-phosphorylation-regulated kinase 1B structureClick to view 3D structureDual specificity tyrosine-phosphorylation-regulated kinase 1BQ9Y463HumansPredicted (SEA)
Prediction Confidence Score
0.255
Applicability Domain
0.308
Statistical Significance
0.1706
Supporting Reference Compounds
377
E-value
1328.26
Click to view 3D structureDual specificity protein kinase CLK1P22518Mus musculusPredicted (SEA)
Prediction Confidence Score
0.255
Applicability Domain
0.308
Statistical Significance
0.0085
Supporting Reference Compounds
56
E-value
65.9383
Click to view 3D structureDual specificity protein kinase CLK4O35493Mus musculusPredicted (SEA)
Prediction Confidence Score
0.255
Applicability Domain
0.308
Statistical Significance
0.0051
Supporting Reference Compounds
33
E-value
39.9366
Click to view 3D structureDual specificity protein kinase CLK2O35491Mus musculusPredicted (SEA)
Prediction Confidence Score
0.255
Applicability Domain
0.308
Statistical Significance
0.0047
Supporting Reference Compounds
30
E-value
36.2777
Click to view 3D structureDual specificity protein kinase CLK3O35492Mus musculusPredicted (SEA)
Prediction Confidence Score
0.254
Applicability Domain
0.308
Statistical Significance
0.0024
Supporting Reference Compounds
23
E-value
19.0731
Click to view 3D structureATP-dependent molecular chaperone HSP82C4YTQ8Candida albicans (strain WO-1) (Yeast)Predicted (SEA)
Prediction Confidence Score
0.254
Applicability Domain
0.292 Low confidence
Statistical Significance
0.0559
Supporting Reference Compounds
205
E-value
435.411
Dual specificity protein kinase CLK4 structureClick to view 3D structureDual specificity protein kinase CLK4Q9HAZ1HumansPredicted (SEA)
Prediction Confidence Score
0.251
Applicability Domain
0.308
Statistical Significance
0.3029
Supporting Reference Compounds
742
E-value
2358.29
Dual specificity tyrosine-phosphorylation-regulated kinase 2 structureClick to view 3D structureDual specificity tyrosine-phosphorylation-regulated kinase 2Q92630HumansPredicted (SEA)
Prediction Confidence Score
0.251
Applicability Domain
0.308
Statistical Significance
0.0863
Supporting Reference Compounds
196
E-value
671.527
Sentrin-specific protease 7 structureClick to view 3D structureSentrin-specific protease 7Q9BQF6HumansPredicted (SEA)
Prediction Confidence Score
0.25
Applicability Domain
0.293 Low confidence
Statistical Significance
0.0656
Supporting Reference Compounds
118
E-value
510.847
Click to view 3D structureStreptokinase AP10520Streptococcus pyogenes serotype M1Predicted (SEA)
Prediction Confidence Score
0.25
Applicability Domain
0.275 Low confidence
Statistical Significance
0.1374
Supporting Reference Compounds
425
E-value
1069.65
Mast/stem cell growth factor receptor Kit structureClick to view 3D structureMast/stem cell growth factor receptor KitP10721HumansPredicted (SEA)
Prediction Confidence Score
0.25
Applicability Domain
0.316
Statistical Significance
0.3492
Supporting Reference Compounds
905
E-value
2718.88
Aurora kinase A structureClick to view 3D structureAurora kinase AO14965HumansPredicted (SEA)
Prediction Confidence Score
0.249
Applicability Domain
0.316
Statistical Significance
0.3728
Supporting Reference Compounds
996
E-value
2902.45
Apoptotic protease-activating factor 1 structureClick to view 3D structureApoptotic protease-activating factor 1O14727HumansPredicted (SEA)
Prediction Confidence Score
0.249
Applicability Domain
0.293 Low confidence
Statistical Significance
0.0197
Supporting Reference Compounds
112
E-value
153.363
Serine/threonine-protein kinase pim-1 structureClick to view 3D structureSerine/threonine-protein kinase pim-1P11309HumansPredicted (SEA)
Prediction Confidence Score
0.247
Applicability Domain
0.308
Statistical Significance
0.3876
Supporting Reference Compounds
967
E-value
3017.2
Dual specificity tyrosine-phosphorylation-regulated kinase 1A structureClick to view 3D structureDual specificity tyrosine-phosphorylation-regulated kinase 1AQ13627HumansPredicted (SEA)
Prediction Confidence Score
0.247
Applicability Domain
0.308
Statistical Significance
0.3726
Supporting Reference Compounds
906
E-value
2900.66
Cytochrome P450 2D6 structureClick to view 3D structureCytochrome P450 2D6P10635HumansPredicted (SEA)
Prediction Confidence Score
0.246
Applicability Domain
0.3
Statistical Significance
0.5073
Supporting Reference Compounds
1130
E-value
3949.68
Serine/threonine-protein kinase Chk2 structureClick to view 3D structureSerine/threonine-protein kinase Chk2O96017HumansPredicted (SEA)
Prediction Confidence Score
0.244
Applicability Domain
0.316
Statistical Significance
0.2907
Supporting Reference Compounds
537
E-value
2263.39
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available