3-chloro-N-(4-{3-(2-methylpropoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)benzamide
Chemical Structure Depiction of
3-chloro-N-(4-{3-(2-methylpropoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)benzamide
3-chloro-N-(4-{3-(2-methylpropoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)benzamide
Compound characteristics
| Compound ID: | V009-9289 |
| Compound Name: | 3-chloro-N-(4-{3-(2-methylpropoxy)-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)benzamide |
| Molecular Weight: | 514.93 |
| Molecular Formula: | C26 H22 Cl F3 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)COc1nc(c2cccc(c2)C(F)(F)F)n(c2ccc(cc2)NC(c2cccc(c2)[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.4929 |
| logD: | 7.4922 |
| logSw: | -6.5623 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.28 |
| InChI Key: | YVOBLPPVSCQTCJ-UHFFFAOYSA-N |