2-{[5-(4-butoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-{[5-(4-butoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
2-{[5-(4-butoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | Y207-3770 |
| Compound Name: | 2-{[5-(4-butoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C24 H30 N4 O2 S |
| Smiles: | CCCCOc1ccc(cc1)c1nnc(n1CC)SCC(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7178 |
| logD: | 4.7178 |
| logSw: | -4.413 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.696 |
| InChI Key: | NFWVHYDNJVRGBF-UHFFFAOYSA-N |