1-[5-(3-nitrophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
Chemical Structure Depiction of
1-[5-(3-nitrophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
1-[5-(3-nitrophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
Compound characteristics
| Compound ID: | 3306-0053 |
| Compound Name: | 1-[5-(3-nitrophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one |
| Molecular Weight: | 323.35 |
| Molecular Formula: | C18 H17 N3 O3 |
| Smiles: | CCC(N1C(CC(c2ccccc2)=N1)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8786 |
| logD: | 3.8786 |
| logSw: | -3.9997 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.24 |
| InChI Key: | IAAJMOPIVNWXGQ-KRWDZBQOSA-N |