{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{5-[(4-bromobenzene-1-sulfonyl)methyl]furan-2-yl}methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{5-[(4-bromobenzene-1-sulfonyl)methyl]furan-2-yl}methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{5-[(4-bromobenzene-1-sulfonyl)methyl]furan-2-yl}methanone
Compound characteristics
| Compound ID: | K788-8192 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{5-[(4-bromobenzene-1-sulfonyl)methyl]furan-2-yl}methanone |
| Molecular Weight: | 547.42 |
| Molecular Formula: | C24 H23 Br N2 O6 S |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(c1ccc(CS(c2ccc(cc2)[Br])(=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6757 |
| logD: | 3.4882 |
| logSw: | -3.9769 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.149 |
| InChI Key: | SSLPUYSZYWNJHA-UHFFFAOYSA-N |