6-[3-(4-benzylpiperidin-1-yl)-3-oxopropane-1-sulfonyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-[3-(4-benzylpiperidin-1-yl)-3-oxopropane-1-sulfonyl]-2H-1,4-benzothiazin-3(4H)-one
6-[3-(4-benzylpiperidin-1-yl)-3-oxopropane-1-sulfonyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | E511-1120 |
| Compound Name: | 6-[3-(4-benzylpiperidin-1-yl)-3-oxopropane-1-sulfonyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 458.6 |
| Molecular Formula: | C23 H26 N2 O4 S2 |
| Smiles: | C1CN(CCC1Cc1ccccc1)C(CCS(c1ccc2c(c1)NC(CS2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6634 |
| logD: | 2.6634 |
| logSw: | -3.2991 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.945 |
| InChI Key: | PJWYLSPCDYMPLL-UHFFFAOYSA-N |