{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-chlorothieno[3,2-c]quinolin-2-yl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-chlorothieno[3,2-c]quinolin-2-yl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-chlorothieno[3,2-c]quinolin-2-yl)methanone
Compound characteristics
| Compound ID: | C593-0087 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-chlorothieno[3,2-c]quinolin-2-yl)methanone |
| Molecular Weight: | 465.96 |
| Molecular Formula: | C24 H20 Cl N3 O3 S |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(c1cc2c(nc3ccccc3c2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7685 |
| logD: | 4.5838 |
| logSw: | -4.9607 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.258 |
| InChI Key: | RZIVERDQEKZLGZ-UHFFFAOYSA-N |