4-[(2-methoxy-4-nitroanilino)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(2-methoxy-4-nitroanilino)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-[(2-methoxy-4-nitroanilino)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8003-4205 |
| Compound Name: | 4-[(2-methoxy-4-nitroanilino)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 352.35 |
| Molecular Formula: | C18 H16 N4 O4 |
| Smiles: | CC1\C(=C/Nc2ccc(cc2OC)[N+]([O-])=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.062 |
| logD: | 2.8643 |
| logSw: | -3.5366 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.502 |
| InChI Key: | INLSQRQXBZRBMV-UHFFFAOYSA-N |