AC1MNTBH
2-[[5-[(3,4-dichloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenoxyphenyl)acetamide
Also Known As: A3058/0129178|2-({5-[(3,4-DICHLOROANILINO)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL}SULFANYL)-N-(4-PHENOXYPHENYL)ACETAMIDE|2-[(5-{[(3,4-dichlorophenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide|2-((5-(((3,4-Dichlorophenyl)amino)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(4-phenoxyphenyl)acetamide|2-((5-((3,4-DICHLOROANILINO)METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL)-N-(4-PHENOXYPHENYL)ACETAMIDE|2-[[5-[(3,4-dichloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenoxyphenyl)acetamide|644-707-8
| Molecular Formula | C29H23Cl2N5O2S |
|---|---|
| Molecular Weight | 575.095 g/mol |
| LogP | 7.7093 |
| Topological Polar Surface Area | 81.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 575.095 |
| Monoisotopic Mass | 575.095 |
| Heavy Atoms | 39 |
| Complexity | 1547.777 |
Chemical Identifiers
| CAS Number | 539809-57-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)CNC5=CC(=C(C=C5)Cl)Cl |
Product Overview
AC1MNTBH (CAS 539809-57-9), with molecular formula C29H23Cl2N5O2S and molecular weight 575.095 g/mol. IUPAC: 2-[[5-[(3,4-dichloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenoxyphenyl)acetamide.