2-[(4,5-diethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(4,5-diethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide
2-[(4,5-diethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | Y206-5335 |
| Compound Name: | 2-[(4,5-diethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide |
| Molecular Weight: | 334.44 |
| Molecular Formula: | C16 H22 N4 O2 S |
| Smiles: | CCc1nnc(n1CC)SCC(Nc1ccccc1OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5978 |
| logD: | 2.5977 |
| logSw: | -3.0218 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.875 |
| InChI Key: | ZBMXJHUKIQWDFE-UHFFFAOYSA-N |