4-[(4-acetylanilino)methylidene]-5-methyl-2-(2-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(4-acetylanilino)methylidene]-5-methyl-2-(2-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
4-[(4-acetylanilino)methylidene]-5-methyl-2-(2-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8004-3385 |
| Compound Name: | 4-[(4-acetylanilino)methylidene]-5-methyl-2-(2-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C20 H19 N3 O2 |
| Smiles: | CC1\C(=C/Nc2ccc(cc2)C(C)=O)C(N(c2ccccc2C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2263 |
| logD: | 3.2245 |
| logSw: | -3.4985 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.714 |
| InChI Key: | QNLJJGXRBFUSFA-UHFFFAOYSA-N |