1-[1-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4-(2-fluorophenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Chemical Structure Depiction of
1-[1-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4-(2-fluorophenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
1-[1-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4-(2-fluorophenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Compound characteristics
| Compound ID: | 5868-0254 |
| Compound Name: | 1-[1-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4-(2-fluorophenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one |
| Molecular Weight: | 436.92 |
| Molecular Formula: | C24 H22 Cl F N4 O |
| Smiles: | CC(C1=NN(C(c2ccc(cc2)N(C)C)N1c1ccccc1F)c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7263 |
| logD: | 5.6994 |
| logSw: | -6.2029 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.187 |
| InChI Key: | CWRMBSVULOHESE-DEOSSOPVSA-N |