N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methyl-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methyl-3-(trifluoromethyl)benzamide
N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methyl-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V003-5339 |
| Compound Name: | N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methyl-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 484.45 |
| Molecular Formula: | C25 H20 F4 N4 O2 |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2cccc(c2)F)n(c2ccc(cc2)NC(c2ccc(C)c(c2)C(F)(F)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.6211 |
| logD: | 6.6207 |
| logSw: | -5.6853 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.905 |
| InChI Key: | JSEMWAVCJARJLE-UHFFFAOYSA-N |