1-(3-chloro-4-methylphenyl)-4-[(4-hydroxy-3-nitrophenyl)methylidene]pyrazolidine-3,5-dione
Chemical Structure Depiction of
1-(3-chloro-4-methylphenyl)-4-[(4-hydroxy-3-nitrophenyl)methylidene]pyrazolidine-3,5-dione
1-(3-chloro-4-methylphenyl)-4-[(4-hydroxy-3-nitrophenyl)methylidene]pyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | 3697-0211 |
| Compound Name: | 1-(3-chloro-4-methylphenyl)-4-[(4-hydroxy-3-nitrophenyl)methylidene]pyrazolidine-3,5-dione |
| Molecular Weight: | 373.75 |
| Molecular Formula: | C17 H12 Cl N3 O5 |
| Smiles: | Cc1ccc(cc1[Cl])N1C(C(=C/c2ccc(c(c2)[N+]([O-])=O)O)\C(N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5528 |
| logD: | 2.7596 |
| logSw: | -3.8164 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.388 |
| InChI Key: | XRODALWPPVLWDX-UHFFFAOYSA-N |