5-methyl-4-(4-nitrobenzoyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-methyl-4-(4-nitrobenzoyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
5-methyl-4-(4-nitrobenzoyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1650-0063 |
| Compound Name: | 5-methyl-4-(4-nitrobenzoyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 323.31 |
| Molecular Formula: | C17 H13 N3 O4 |
| Smiles: | CC1C(C(c2ccc(cc2)[N+]([O-])=O)=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5439 |
| logD: | -0.8922 |
| logSw: | -2.7252 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.707 |
| InChI Key: | QHRMOZIIQNCORN-OAHLLOKOSA-N |