N-[(4-methylphenyl)methyl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-[(4-methylphenyl)methyl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G731-0060 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 338.43 |
| Molecular Formula: | C18 H18 N4 O S |
| Smiles: | Cc1ccc(CNC(CSc2nnc(c3ccccc3)[nH]2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8604 |
| logD: | 1.6687 |
| logSw: | -3.1508 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.945 |
| InChI Key: | ANARSIFMCWWFMH-UHFFFAOYSA-N |