(2H-1,3-benzodioxol-5-yl){4-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl){4-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}methanone
(2H-1,3-benzodioxol-5-yl){4-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | Y502-5338 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl){4-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}methanone |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C24 H26 N4 O3 |
| Smiles: | Cc1c(CN2CCN(CC2)C(c2ccc3c(c2)OCO3)=O)c(C)n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.5048 |
| logD: | 1.9403 |
| logSw: | -2.8304 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.961 |
| InChI Key: | BKZYAVMAJSKPSP-UHFFFAOYSA-N |