N,N'-(4-Chloro-1,2-phenylene)bis(4-methylbenzenesulfonamide) - CAS 27185-54-2

Name: N,N'-(4-Chloro-1,2-phenylene)bis(4-methylbenzenesulfonamide)
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB019492
Product Name:	N,N'-(4-Chloro-1,2-phenylene)bis(4-methylbenzenesulfonamide)
CAS:	27185-54-2
Synonyms:	N-[4-chloro-2-[(4-methylphenyl)sulfonylamino]phenyl]-4-methylbenzenesulfonamide; N-[4-chloro-2-[(4-methylphenyl)sulfonylamino]phenyl]-4-methylbenzenesulfonamide

Technical Data

IUPAC Name:	N-[4-chloro-2-[(4-methylphenyl)sulfonylamino]phenyl]-4-methylbenzenesulfonamide
Description:	N,N'-(4-Chloro-1,2-phenylene)bis(4-methylbenzenesulfonamide) (CAS# 27185-54-2 ) is a useful research chemical.
Molecular Weight:	450.96
Molecular Formula:	C20H19ClN2O4S2
Canonical SMILES:	CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)C
InChI:	InChI=1S/C20H19ClN2O4S2/c1-14-3-8-17(9-4-14)28(24,25)22-19-12-7-16(21)13-20(19)23-29(26,27)18-10-5-15(2)6-11-18/h3-13,22-23H,1-2H3
InChI Key:	BEZPYPAEIOOQEZ-UHFFFAOYSA-N
LogP:	6.86600

Publication Number	Title	Priority Date
US-2006004197-A1	Sulfonamide-based compounds as protein tyrosine kinase inhibitors	20040702
WO-2006014405-A2	Sulfonamide-based compounds as protein tyrosine kinase inhibitors	20040702
AU-7805400-A	Enzyme inhibitors	19991015
CA-2387593-A1	Enzyme inhibitors	19991015
EP-1239852-A2	Bissulfonamide derivatives as enzyme inhibitors	19991015

Complexity:	731
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	450.0474771
Formal Charge:	0
Heavy Atom Count:	29
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	450.0474771
Rotatable Bond Count:	6
Topological Polar Surface Area:	109
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.3