{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-ethylthiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-ethylthiophen-2-yl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-ethylthiophen-2-yl)methanone
Compound characteristics
| Compound ID: | Y207-3586 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-ethylthiophen-2-yl)methanone |
| Molecular Weight: | 358.46 |
| Molecular Formula: | C19 H22 N2 O3 S |
| Smiles: | CCc1ccc(C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.4301 |
| logD: | 3.2453 |
| logSw: | -3.6028 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.561 |
| InChI Key: | ICADXVYAYIDIRO-UHFFFAOYSA-N |