AC1OBT9F

4-[(E)-[[2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]benzoic acid

Also Known As: 4-{(E)-[2-({[4,5-bis(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoic acid|(E)-4-((2-(2-((4,5-di-p-tolyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)benzoic acid|4-((1E)-2-{2-[4,5-bis(4-methylphenyl)(1,2,4-triazol-3-ylthio)]acetylamino}-2-a zavinyl)benzoic acid|4-[(E)-[[2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]benzoic acid|4-{(E)-[({[4,5-bis(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio}acetyl)hydrazono]methyl}benzoic acid

Molecular Formula	C26H23N5O3S
Molecular Weight	485.15216 g/mol
LogP	4.49174
Topological Polar Surface Area	109.47 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	485.15216
Monoisotopic Mass	485.15216
Heavy Atoms	35
Complexity	1361.88

Chemical Identifiers

CAS Number	488707-34-2
SMILES	CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)C)SCC(=O)N/N=C/C4=CC=C(C=C4)C(=O)O