N-{4-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{4-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-4-(trifluoromethyl)benzamide
N-{4-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V004-9802 |
| Compound Name: | N-{4-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 458.46 |
| Molecular Formula: | C22 H17 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2cccs2)n(c2ccc(cc2)NC(c2ccc(cc2)C(F)(F)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7492 |
| logD: | 5.7491 |
| logSw: | -5.4961 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.923 |
| InChI Key: | YDQJUQXLJRIXPX-UHFFFAOYSA-N |