5-{[(4-chlorophenyl)sulfanyl]methyl}-4-{[4-(dimethylamino)phenyl]methylidene}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-{[(4-chlorophenyl)sulfanyl]methyl}-4-{[4-(dimethylamino)phenyl]methylidene}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
5-{[(4-chlorophenyl)sulfanyl]methyl}-4-{[4-(dimethylamino)phenyl]methylidene}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 3947-1890 |
| Compound Name: | 5-{[(4-chlorophenyl)sulfanyl]methyl}-4-{[4-(dimethylamino)phenyl]methylidene}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 447.99 |
| Molecular Formula: | C25 H22 Cl N3 O S |
| Smiles: | CN(C)c1ccc(\C=C2/C(CSc3ccc(cc3)[Cl])=NN(C2=O)c2ccccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0142 |
| logD: | 6.0141 |
| logSw: | -6.3237 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.8504 |
| InChI Key: | RVXQGAFYZOPAGM-UHFFFAOYSA-N |