2-(1-ethyl-1H-pyrazol-4-yl)-N-(1-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,2,4-triazol-3-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
2-(1-ethyl-1H-pyrazol-4-yl)-N-(1-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,2,4-triazol-3-yl)quinoline-4-carboxamide
2-(1-ethyl-1H-pyrazol-4-yl)-N-(1-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,2,4-triazol-3-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y502-8900 |
| Compound Name: | 2-(1-ethyl-1H-pyrazol-4-yl)-N-(1-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,2,4-triazol-3-yl)quinoline-4-carboxamide |
| Molecular Weight: | 491.47 |
| Molecular Formula: | C25 H20 F3 N7 O |
| Smiles: | CCn1cc(cn1)c1cc(C(Nc2ncn(Cc3cccc(c3)C(F)(F)F)n2)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4307 |
| logD: | 4.4279 |
| logSw: | -4.2129 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.112 |
| InChI Key: | ZUOTXQBOLQODFT-UHFFFAOYSA-N |