Diethyl 2-[[4-[(4-methylphenyl)sulfonyl-octylamino]benzoyl]amino]pentanedioate

diethyl 2-[[4-[(4-methylphenyl)sulfonyl-octylamino]benzoyl]amino]pentanedioate

Also Known As: diethyl 2-[[4-[(4-methylphenyl)sulfonyl-octylamino]benzoyl]amino]pentanedioate|diethyl n-(4-{[(4-methylphenyl)sulfonyl](octyl)amino}benzoyl)glutamate|diethyl (4-((4-methyl-N-octylphenyl)sulfonamido)benzoyl)glutamate|diethyl 2-[[4-[octyl(p-tolylsulfonyl)amino]benzoyl]amino]pentanedioate|Diethyl N-{4-[[(4-methylphenyl)sulfonyl](octyl)amino]benzoyl}glutamate

Molecular Formula	C31H44N2O7S
Molecular Weight	588.2869 g/mol
LogP	6.6
Topological Polar Surface Area	127.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	20
Exact Mass	588.2869
Monoisotopic Mass	588.2869
Heavy Atoms	41
Complexity	889.0

Chemical Identifiers

CAS Number	83589-46-2
SMILES	CCCCCCCCN(C1=CC=C(C=C1)C(=O)NC(CCC(=O)OCC)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)C
InChIKey	XWBJRJFMCJWWOB-UHFFFAOYSA-N