N-(5-methylpyridin-2-yl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Chemical Structure Depiction of
N-(5-methylpyridin-2-yl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
N-(5-methylpyridin-2-yl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Compound characteristics
Compound ID: | E589-2479 |
Compound Name: | N-(5-methylpyridin-2-yl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide |
Molecular Weight: | 446.55 |
Molecular Formula: | C20 H22 N4 O4 S2 |
Smiles: | Cc1ccc(NC(CN2C(CSc3ccc(cc23)S(N2CCCC2)(=O)=O)=O)=O)nc1 |
Stereo: | ACHIRAL |
logP: | 2.8196 |
logD: | 2.8192 |
logSw: | -3.3592 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.55 |
InChI Key: | RDPBNOJJSGXEEL-UHFFFAOYSA-N |