N-(4-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}phenyl)acetamide
N-(4-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}phenyl)acetamide
Compound characteristics
| Compound ID: | 8415-04100 |
| Compound Name: | N-(4-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}phenyl)acetamide |
| Molecular Weight: | 366.44 |
| Molecular Formula: | C19 H18 N4 O2 S |
| Smiles: | CC(Nc1ccc(cc1)C(CSc1nnc(c2ccccc2)n1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4382 |
| logD: | 2.4381 |
| logSw: | -2.7727 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.56 |
| InChI Key: | AKOKNGBDHZSMHS-UHFFFAOYSA-N |