4-{[2-methoxy-4-(piperidine-1-sulfonyl)anilino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[2-methoxy-4-(piperidine-1-sulfonyl)anilino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-{[2-methoxy-4-(piperidine-1-sulfonyl)anilino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y508-3632 |
| Compound Name: | 4-{[2-methoxy-4-(piperidine-1-sulfonyl)anilino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C23 H26 N4 O4 S |
| Smiles: | CC1/C(=C/Nc2ccc(cc2OC)S(N2CCCCC2)(=O)=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2762 |
| logD: | 3.2017 |
| logSw: | -3.727 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.831 |
| InChI Key: | CNHURGLJEPASDF-SILNSSARSA-N |