2-(4-benzylpiperazin-1-yl)-1-[3-(3,4-dimethylphenyl)-5-(3-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-1-[3-(3,4-dimethylphenyl)-5-(3-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(4-benzylpiperazin-1-yl)-1-[3-(3,4-dimethylphenyl)-5-(3-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V022-0528 |
| Compound Name: | 2-(4-benzylpiperazin-1-yl)-1-[3-(3,4-dimethylphenyl)-5-(3-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 484.62 |
| Molecular Formula: | C30 H33 F N4 O |
| Smiles: | Cc1ccc(cc1C)C1CC(c2cccc(c2)F)N(C(CN2CCN(CC2)Cc2ccccc2)=O)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3761 |
| logD: | 5.2371 |
| logSw: | -5.4233 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.132 |
| InChI Key: | XSUIHIBKQDVHPU-LJAQVGFWSA-N |