[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]phenyl]boronic acid (CED0190973)

Record Information

Version

1.0

Creation Date

2026-08-20 00:04:04 UTC

Update Date

2026-08-20 00:04:04 UTC

Accession Number

CHEM195570

Identification

Common Name

[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]phenyl]boronic acid

Class

Small Molecule

Description

[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]phenyl]boronic acid is an organic compound with the formula C18H19BN2O4S and an average molecular weight of 370.20 g/mol. [3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]phenyl]boronic acid belongs to the naphthalene sulfonic acids and derivatives, a subclass of naphthalenes within the organic compounds. This substance is further classified within the benzenoids superclass. The compound is found in or released from five recorded sources, all of which are electrical and electronic equipment. These sources include microphones, amplifiers, video games, television systems, and radio transmission systems.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₈H₁₉BN₂O₄S

Average Molecular Mass

370.200 g/mol

Monoisotopic Mass

370.116 g/mol

CAS Registry Number

75806-94-9

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C18H19BN2O4S/c1-21(2)17-10-4-9-16-15(17)8-5-11-18(16)26(24,25)20-14-7-3-6-13(12-14)19(22)23/h3-12,20,22-23H,1-2H3

InChI Key

TYXMKSYBCDTGDU-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Not Available

Toxicity Profile

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Toxicity Values

Toxicity Value	Unit	Value Range	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Reference
5325.0	Log mg/kg	[3000:9500]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
505	Amplifiers	Electrical & Electronic Equipment	Not Available
528	Microphones	Electrical & Electronic Equipment	Not Available
530	Radio Transmission Systems	Electrical & Electronic Equipment	Not Available
537	Television Systems	Electrical & Electronic Equipment	Not Available
539	Video Games	Electrical & Electronic Equipment	Not Available
579	Manufacture Of Iron Or Steel	Industrial manufacturing & chemical processing	Not Available

Pathways

0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Beta-xylosidase	P36906	Thermoanaerobacterium saccharolyticum	Predicted (SEA)	1.01204
Click to view 3D structure	Beta-galactosidase	Q59750	Sinorhizobium meliloti	Predicted (SEA)	1.79053
Click to view 3D structure	Beta-galactosidase	P16278	Humans	Predicted (SEA)	1.63483
Click to view 3D structure	Putative beta-hexosaminidase	Q9RK76	Streptomyces coelicolor (strain ATCC BAA-471 / A3(2) / M145)	Predicted (SEA)	1.55698
Click to view 3D structure	Beta-glucosidase	P12614	Agrobacterium sp. ATCC 21400	Predicted (SEA)	1.01204
Click to view 3D structure	Protein deacetylase HDAC6	Q9UBN7	Humans	Predicted (SEA)	952.174
Click to view 3D structure	Vascular endothelial growth factor receptor 1	P17948	Humans	Predicted (SEA)	1359.25
Click to view 3D structure	Histone deacetylase 4	P56524	Humans	Predicted (SEA)	443.429
Click to view 3D structure	Vascular endothelial growth factor receptor 2	P35968	Humans	Predicted (SEA)	2800.55
Click to view 3D structure	5-hydroxytryptamine receptor 6	P50406	Humans	Predicted (SEA)	999.662
Click to view 3D structure	6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 4	Q16877	Humans	Predicted (SEA)	4.82665
Click to view 3D structure	Histone deacetylase 5	Q9UQL6	Humans	Predicted (SEA)	583.48
Click to view 3D structure	Tyrosine-protein kinase Lck	P06239	Humans	Predicted (SEA)	2928.06
Click to view 3D structure	Rho-associated protein kinase 1	Q13464	Humans	Predicted (SEA)	2548.08
Click to view 3D structure	Protein RecA	P9WHJ3	Mycobacterium tuberculosis	Predicted (SEA)	752.88
Click to view 3D structure	Polyamine deacetylase HDAC10	Q969S8	Humans	Predicted (SEA)	535.603
Click to view 3D structure	Aurora kinase B	Q96GD4	Humans	Predicted (SEA)	2970.88
Click to view 3D structure	ALK tyrosine kinase receptor	Q9UM73	Humans	Predicted (SEA)	2501.61
Click to view 3D structure	Mitogen-activated protein kinase kinase kinase kinase 4	O95819	Humans	Predicted (SEA)	2602.11
Click to view 3D structure	Tyrosine-protein kinase Fyn	P06241	Humans	Predicted (SEA)	2577.12
Click to view 3D structure	Serine/threonine-protein kinase Chk1	O14757	Humans	Predicted (SEA)	2753.92
Click to view 3D structure	Serine/threonine-protein kinase Nek2	P51955	Humans	Predicted (SEA)	2494.37
Click to view 3D structure	Tyrosine-protein kinase JAK3	P52333	Humans	Predicted (SEA)	3053.25
Click to view 3D structure	Mitogen-activated protein kinase 8	P45983	Humans	Predicted (SEA)	2986.14
Click to view 3D structure	Glycogen synthase kinase-3 beta	P49841	Humans	Predicted (SEA)	3510.53