1-[4-(4-chlorophenyl)-5-{2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl}-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-chlorophenyl)-5-{2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl}-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
1-[4-(4-chlorophenyl)-5-{2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl}-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8011-1560 |
| Compound Name: | 1-[4-(4-chlorophenyl)-5-{2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl}-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one |
| Molecular Weight: | 560.48 |
| Molecular Formula: | C31 H27 Cl2 N3 O3 |
| Smiles: | CCOc1cccc(C2N(C(C(C)=O)=NN2c2ccccc2)c2ccc(cc2)[Cl])c1OCc1ccccc1[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.9455 |
| logD: | 7.9455 |
| logSw: | -6.3417 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.294 |
| InChI Key: | XVDZXVQAAOQVOR-HKBQPEDESA-N |