4-[(3,4-dichlorophenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(3,4-dichlorophenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-[(3,4-dichlorophenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2339-2218 |
| Compound Name: | 4-[(3,4-dichlorophenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 406.22 |
| Molecular Formula: | C18 H13 Cl2 N3 O4 |
| Smiles: | CCOC1/C(=C/c2ccc(c(c2)[Cl])[Cl])C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.065 |
| logD: | 5.065 |
| logSw: | -5.5527 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.947 |
| InChI Key: | RPHVWHYCHVSOTC-UHFFFAOYSA-N |