4-{[5-(2-chlorophenyl)furan-2-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[5-(2-chlorophenyl)furan-2-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-{[5-(2-chlorophenyl)furan-2-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1503-0070 |
| Compound Name: | 4-{[5-(2-chlorophenyl)furan-2-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 362.81 |
| Molecular Formula: | C21 H15 Cl N2 O2 |
| Smiles: | CC1/C(=C/c2ccc(c3ccccc3[Cl])o2)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0164 |
| logD: | 5.0163 |
| logSw: | -5.0173 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.157 |
| InChI Key: | XQFPXOWDQAYSTM-UHFFFAOYSA-N |