AC1LXHOL
N-[4-[2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]benzenesulfonamide
Also Known As: CBMicro_003475|ChemDiv1_005227|HMS601N13|BIM-0003382.P001|F0818-0070|SR-01000445652-1|N-(4-(2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetyl)phenyl)benzenesulfonamide|N-[4-(2-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)phenyl]benzenesulfonamide|N-[4-[2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]benzenesulfonamide|N-[4-({[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)phenyl]benzenesulfonamide|2-(4-phenyl-5-(4-pyridyl)(1,2,4-triazol-3-ylthio))-1-{4-[(phenylsulfonyl)amino ]phenyl}ethan-1-one|2-[4-phenyl-5-(4-pyridyl)-4H-1,2,4-triazol-3-ylthio]-1-[p-(phenylsulfonylamino)phenyl]-1-ethanone
| Molecular Formula | C27H21N5O3S2 |
|---|---|
| Molecular Weight | 527.1086 g/mol |
| LogP | 5.1051 |
| Topological Polar Surface Area | 106.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 527.1086 |
| Monoisotopic Mass | 527.1086 |
| Heavy Atoms | 37 |
| Complexity | 1607.7552 |
Chemical Identifiers
| CAS Number | 326007-99-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4)C5=CC=NC=C5 |
Product Overview
AC1LXHOL (CAS 326007-99-2), with molecular formula C27H21N5O3S2 and molecular weight 527.1086 g/mol. IUPAC: N-[4-[2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]benzenesulfonamide.