{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-bromothiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-bromothiophen-2-yl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-bromothiophen-2-yl)methanone
Compound characteristics
| Compound ID: | Y202-9324 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(4-bromothiophen-2-yl)methanone |
| Molecular Weight: | 409.3 |
| Molecular Formula: | C17 H17 Br N2 O3 S |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(c1cc(cs1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2647 |
| logD: | 3.0799 |
| logSw: | -3.2467 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.561 |
| InChI Key: | OBJMIHXNCAWMTC-UHFFFAOYSA-N |