2-({5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-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-methylphenyl)acetamide
2-({5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | 8013-9070 |
| Compound Name: | 2-({5-[(3-chloro-2-methylanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 478.01 |
| Molecular Formula: | C25 H24 Cl N5 O S |
| Smiles: | Cc1cccc(c1)NC(CSc1nnc(CNc2cccc(c2C)[Cl])n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4913 |
| logD: | 5.4913 |
| logSw: | -5.9041 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.646 |
| InChI Key: | OACGPQZCMXGZAD-UHFFFAOYSA-N |