1-{4-(3,4-dichlorophenyl)-5-[4-(dimethylamino)phenyl]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-(3,4-dichlorophenyl)-5-[4-(dimethylamino)phenyl]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethan-1-one
1-{4-(3,4-dichlorophenyl)-5-[4-(dimethylamino)phenyl]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethan-1-one
Compound characteristics
| Compound ID: | 8009-1278 |
| Compound Name: | 1-{4-(3,4-dichlorophenyl)-5-[4-(dimethylamino)phenyl]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethan-1-one |
| Molecular Weight: | 453.37 |
| Molecular Formula: | C24 H22 Cl2 N4 O |
| Smiles: | CC(C1=NN(C(c2ccc(cc2)N(C)C)N1c1ccc(c(c1)[Cl])[Cl])c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4027 |
| logD: | 6.3758 |
| logSw: | -6.3403 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.488 |
| InChI Key: | FMEQBRHMGCAQLG-DEOSSOPVSA-N |