{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-chloro-2-fluorophenyl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-chloro-2-fluorophenyl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-chloro-2-fluorophenyl)methanone
Compound characteristics
| Compound ID: | Y300-3453 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-chloro-2-fluorophenyl)methanone |
| Molecular Weight: | 376.81 |
| Molecular Formula: | C19 H18 Cl F N2 O3 |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(c1ccc(cc1F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4522 |
| logD: | 3.2606 |
| logSw: | -3.865 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.543 |
| InChI Key: | KBQIVIRAEZAVMT-UHFFFAOYSA-N |