4-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1501-0817 |
| Compound Name: | 4-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 397.26 |
| Molecular Formula: | C21 H14 Cl2 N2 O2 |
| Smiles: | CC1/C(=C\c2ccc(c3cc(ccc3[Cl])[Cl])o2)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7656 |
| logD: | 5.7656 |
| logSw: | -5.9473 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.157 |
| InChI Key: | OKJUXLUYSURGBI-UHFFFAOYSA-N |