N-(4-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(4-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)thiophene-2-carboxamide
N-(4-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V001-0184 |
| Compound Name: | N-(4-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)thiophene-2-carboxamide |
| Molecular Weight: | 458.46 |
| Molecular Formula: | C22 H17 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2cccc(c2)C(F)(F)F)n(c2ccc(cc2)NC(c2cccs2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8703 |
| logD: | 5.8703 |
| logSw: | -5.584 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.923 |
| InChI Key: | MDMMACYOODQAMW-UHFFFAOYSA-N |