2-(4-benzylpiperazin-1-yl)-1-[5-(4-ethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-1-[5-(4-ethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(4-benzylpiperazin-1-yl)-1-[5-(4-ethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V010-3004 |
| Compound Name: | 2-(4-benzylpiperazin-1-yl)-1-[5-(4-ethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 500.62 |
| Molecular Formula: | C30 H33 F N4 O2 |
| Salt: | not_available |
| Smiles: | CCOc1ccc(cc1)C1CC(c2ccc(cc2)F)=NN1C(CN1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7265 |
| logD: | 4.5875 |
| logSw: | -4.2953 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.255 |
| InChI Key: | KXVHAPZHPZISKL-GDLZYMKVSA-N |