4-{[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene}-2-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene}-2-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
4-{[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene}-2-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8011-4173 |
| Compound Name: | 4-{[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene}-2-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 411.29 |
| Molecular Formula: | C22 H16 Cl2 N2 O2 |
| Smiles: | CC1/C(=C\c2ccc(c3cccc(c3C)[Cl])o2)C(N(c2cccc(c2)[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3382 |
| logD: | 6.3382 |
| logSw: | -6.1777 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.157 |
| InChI Key: | DTBLPPLAUAGICC-UHFFFAOYSA-N |