N-(3-{3-(2-ethoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)propanamide
Chemical Structure Depiction of
N-(3-{3-(2-ethoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)propanamide
N-(3-{3-(2-ethoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)propanamide
Compound characteristics
| Compound ID: | V004-3392 |
| Compound Name: | N-(3-{3-(2-ethoxyethoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)propanamide |
| Molecular Weight: | 448.44 |
| Molecular Formula: | C22 H23 F3 N4 O3 |
| Smiles: | CCC(Nc1cccc(c1)n1c(c2cccc(c2)C(F)(F)F)nc(n1)OCCOCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7663 |
| logD: | 4.7663 |
| logSw: | -4.5396 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.235 |
| InChI Key: | XJGMQBSDAHTCQY-UHFFFAOYSA-N |