N-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]acetamide
Compound characteristics
| Compound ID: | K940-0696 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]acetamide |
| Molecular Weight: | 437.9 |
| Molecular Formula: | C19 H20 Cl N3 O5 S |
| Smiles: | C1CN(CCN1CC(Nc1ccc2c(c1)OCO2)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1794 |
| logD: | 3.1793 |
| logSw: | -3.565 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.755 |
| InChI Key: | ITIBNIJXGYOKFS-UHFFFAOYSA-N |