2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxypropyl)acetamide
Chemical Structure Depiction of
2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxypropyl)acetamide
2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxypropyl)acetamide
Compound characteristics
| Compound ID: | G731-0179 |
| Compound Name: | 2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxypropyl)acetamide |
| Molecular Weight: | 340.83 |
| Molecular Formula: | C14 H17 Cl N4 O2 S |
| Smiles: | COCCCNC(CSc1nnc(c2ccccc2[Cl])[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3442 |
| logD: | 0.1525 |
| logSw: | -2.839 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.401 |
| InChI Key: | ZIMMHLSUZYJBMO-UHFFFAOYSA-N |