1-[1-(4-chlorophenyl)-5-{3-[(2,6-dichlorophenyl)methoxy]phenyl}-4-(4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Chemical Structure Depiction of
1-[1-(4-chlorophenyl)-5-{3-[(2,6-dichlorophenyl)methoxy]phenyl}-4-(4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
1-[1-(4-chlorophenyl)-5-{3-[(2,6-dichlorophenyl)methoxy]phenyl}-4-(4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8009-6557 |
| Compound Name: | 1-[1-(4-chlorophenyl)-5-{3-[(2,6-dichlorophenyl)methoxy]phenyl}-4-(4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one |
| Molecular Weight: | 564.9 |
| Molecular Formula: | C30 H24 Cl3 N3 O2 |
| Smiles: | CC(C1=NN(C(c2cccc(c2)OCc2c(cccc2[Cl])[Cl])N1c1ccc(C)cc1)c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.6508 |
| logD: | 8.6508 |
| logSw: | -6.4969 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.911 |
| InChI Key: | RMYYCFOTENVFAS-PMERELPUSA-N |