2-(4-acetylpiperazin-1-yl)-1-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-acetylpiperazin-1-yl)-1-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(4-acetylpiperazin-1-yl)-1-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V016-9164 |
| Compound Name: | 2-(4-acetylpiperazin-1-yl)-1-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 468.94 |
| Molecular Formula: | C24 H25 Cl N4 O4 |
| Smiles: | CC(N1CCN(CC1)CC(N1C(CC(c2ccccc2[Cl])=N1)c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0063 |
| logD: | 3.0059 |
| logSw: | -3.6052 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.902 |
| InChI Key: | AXGXYHUVGFGICE-NRFANRHFSA-N |