{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-bromo-2-chlorophenyl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-bromo-2-chlorophenyl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-bromo-2-chlorophenyl)methanone
Compound characteristics
| Compound ID: | Y204-7336 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-bromo-2-chlorophenyl)methanone |
| Molecular Weight: | 437.72 |
| Molecular Formula: | C19 H18 Br Cl N2 O3 |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(c1cc(ccc1[Cl])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.842 |
| logD: | 3.6504 |
| logSw: | -4.3159 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.543 |
| InChI Key: | CRYYNBSFSGALNL-UHFFFAOYSA-N |