2-({5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-({5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide
2-({5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | 8013-9061 |
| Compound Name: | 2-({5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide |
| Molecular Weight: | 512.46 |
| Molecular Formula: | C25 H23 Cl2 N5 O S |
| Smiles: | Cc1c(cccc1[Cl])NCc1nnc(n1c1ccccc1)SCC(Nc1cccc(c1C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9387 |
| logD: | 5.9385 |
| logSw: | -5.9744 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.949 |
| InChI Key: | GPMUGFFFELSXQO-UHFFFAOYSA-N |