1-(4-chlorophenyl)-4-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}pyrazolidine-3,5-dione
Chemical Structure Depiction of
1-(4-chlorophenyl)-4-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}pyrazolidine-3,5-dione
1-(4-chlorophenyl)-4-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}pyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | Y508-0668 |
| Compound Name: | 1-(4-chlorophenyl)-4-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}pyrazolidine-3,5-dione |
| Molecular Weight: | 429.26 |
| Molecular Formula: | C20 H14 Cl2 N4 O3 |
| Smiles: | Cc1c(\C=C2/C(NN(C2=O)c2ccc(cc2)[Cl])=O)c(n(c2ccc(cc2)[Cl])n1)O |
| Stereo: | ACHIRAL |
| logP: | 2.9965 |
| logD: | 0.7442 |
| logSw: | -3.3672 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.609 |
| InChI Key: | JNYGQUFAAFOPBY-UHFFFAOYSA-N |