4-(2-fluorobenzoyl)-5-(3-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-(2-fluorobenzoyl)-5-(3-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-(2-fluorobenzoyl)-5-(3-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | V008-7930 |
| Compound Name: | 4-(2-fluorobenzoyl)-5-(3-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 433.39 |
| Molecular Formula: | C23 H16 F N3 O5 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C1C(C(c2ccccc2F)=O)C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.28 |
| logD: | -1.9319 |
| logSw: | -4.6038 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.806 |
| InChI Key: | NMGRHVQZCRVUST-HXUWFJFHSA-N |