AC1N7C2H

ethyl 4-[[2-[[4-(2,5-dimethoxyphenyl)-5-[[[4-(dimethylsulfamoyl)benzoyl]amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

Also Known As: F0772-0510|ethyl 4-(2-{[4-(2,5-dimethoxyphenyl)-5-({[4-(dimethylsulfamoyl)phenyl]formamido}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate|ethyl 4-(2-((4-(2,5-dimethoxyphenyl)-5-((4-(N,N-dimethylsulfamoyl)benzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|ethyl 4-[[2-[[4-(2,5-dimethoxyphenyl)-5-[[[4-(dimethylsulfamoyl)benzoyl]amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

Molecular Formula	C31H34N6O8S2
Molecular Weight	682.1879 g/mol
LogP	3.3723
Topological Polar Surface Area	171.05 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	11
Rotatable Bonds	14
Exact Mass	682.1879
Monoisotopic Mass	682.1879
Heavy Atoms	47
Complexity	1842.7194

Chemical Identifiers

CAS Number	309968-35-2
SMILES	CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=C(C=CC(=C3)OC)OC)CNC(=O)C4=CC=C(C=C4)S(=O)(=O)N(C)C