2-(3,4-dimethylphenyl)-5-methyl-4-{[4-(piperidine-1-carbonyl)anilino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-5-methyl-4-{[4-(piperidine-1-carbonyl)anilino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
2-(3,4-dimethylphenyl)-5-methyl-4-{[4-(piperidine-1-carbonyl)anilino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y508-1572 |
| Compound Name: | 2-(3,4-dimethylphenyl)-5-methyl-4-{[4-(piperidine-1-carbonyl)anilino]methylidene}-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 416.52 |
| Molecular Formula: | C25 H28 N4 O2 |
| Smiles: | CC1/C(=C/Nc2ccc(cc2)C(N2CCCCC2)=O)C(N(c2ccc(C)c(C)c2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3212 |
| logD: | 4.3161 |
| logSw: | -4.1998 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.836 |
| InChI Key: | OZARXSYQMZWBHW-UHFFFAOYSA-N |