2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D419-0196 |
| Compound Name: | 2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C20 H17 N5 O S2 |
| Smiles: | Cc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2553 |
| logD: | 4.2548 |
| logSw: | -4.2487 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.34 |
| InChI Key: | HCXACVAFMGXWRT-UHFFFAOYSA-N |