dimethyl 5-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)carbamamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)carbamamido]benzene-1,3-dicarboxylate
dimethyl 5-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)carbamamido]benzene-1,3-dicarboxylate
Compound characteristics
Compound ID: | C791-0266 |
Compound Name: | dimethyl 5-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)carbamamido]benzene-1,3-dicarboxylate |
Molecular Weight: | 429.45 |
Molecular Formula: | C20 H19 N3 O6 S |
Smiles: | CN1C(CSc2ccc(cc12)NC(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6549 |
logD: | 3.6549 |
logSw: | -4.0849 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 90.307 |
InChI Key: | IOYHRMRPGHKXHB-UHFFFAOYSA-N |