2-(4-benzylpiperazin-1-yl)-1-[3-(4-fluorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-1-[3-(4-fluorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(4-benzylpiperazin-1-yl)-1-[3-(4-fluorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V017-2593 |
| Compound Name: | 2-(4-benzylpiperazin-1-yl)-1-[3-(4-fluorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 459.57 |
| Molecular Formula: | C27 H30 F N5 O |
| Salt: | not_available |
| Smiles: | Cn1cccc1C1CC(c2ccc(cc2)F)=NN1C(CN1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.924 |
| logD: | 3.785 |
| logSw: | -3.9605 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.549 |
| InChI Key: | HTNIDEXSJQVWBU-AREMUKBSSA-N |