AC1LTX7I
2-[[5-[(3-chloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide
Also Known As: A3058/0129174|2-((5-(((3-Chlorophenyl)amino)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(m-tolyl)acetamide|2-({5-[(3-CHLOROANILINO)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL}SULFANYL)-N-(3-METHYLPHENYL)ACETAMIDE|2-((5-((3-Chloroanilino)methyl)-4-phenyl-4H-1,2,4-triazol-3-YL)sulfanyl)-N-(3-methylphenyl)acetamide|2-[(5-{[(3-chlorophenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)acetamide|2-[[5-[(3-chloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide|644-709-9
| Molecular Formula | C24H22ClN5OS |
|---|---|
| Molecular Weight | 463.12335 g/mol |
| LogP | 5.57202 |
| Topological Polar Surface Area | 71.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 463.12335 |
| Monoisotopic Mass | 463.12335 |
| Heavy Atoms | 32 |
| Complexity | 1212.0073 |
Chemical Identifiers
| CAS Number | 539809-47-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC(=CC=C4)Cl |
Product Overview
AC1LTX7I (CAS 539809-47-7), with molecular formula C24H22ClN5OS and molecular weight 463.12335 g/mol. IUPAC: 2-[[5-[(3-chloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide.