2-(3-chlorophenyl)-4-({1-[(3,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-4-({1-[(3,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
2-(3-chlorophenyl)-4-({1-[(3,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8009-4199 |
| Compound Name: | 2-(3-chlorophenyl)-4-({1-[(3,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 521.83 |
| Molecular Formula: | C27 H19 Cl3 N4 O |
| Smiles: | CC1/C(=C\c2cn(Cc3ccc(c(c3)[Cl])[Cl])nc2c2ccccc2)C(N(c2cccc(c2)[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7562 |
| logD: | 6.7562 |
| logSw: | -6.3192 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.367 |
| InChI Key: | QAAVTEKVRMOABW-UHFFFAOYSA-N |