N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-methoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-methoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-(trifluoromethyl)benzamide
N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-methoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V007-1378 |
| Compound Name: | N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-methoxyethoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 526.47 |
| Molecular Formula: | C26 H21 F3 N4 O5 |
| Salt: | not_available |
| Smiles: | COCCOc1nc(c2ccc3c(c2)OCO3)n(c2ccc(cc2)NC(c2ccc(cc2)C(F)(F)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.99 |
| logD: | 4.9899 |
| logSw: | -4.7192 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.657 |
| InChI Key: | MXXJDVZLPCIXDK-UHFFFAOYSA-N |