N-(4-{3-[(4-fluorophenyl)methoxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(4-{3-[(4-fluorophenyl)methoxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2H-1,3-benzodioxole-5-carboxamide
N-(4-{3-[(4-fluorophenyl)methoxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V007-9406 |
| Compound Name: | N-(4-{3-[(4-fluorophenyl)methoxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 576.51 |
| Molecular Formula: | C30 H20 F4 N4 O4 |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)F)Oc1nc(c2ccc(cc2)C(F)(F)F)n(c2ccc(cc2)NC(c2ccc3c(c2)OCO3)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.1347 |
| logD: | 7.1347 |
| logSw: | -6.2435 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.124 |
| InChI Key: | DMEVWIWOKDFWJP-UHFFFAOYSA-N |