methyl 2-{3-[(2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine-1-carbonyl)amino]benzamido}benzoate
Chemical Structure Depiction of
methyl 2-{3-[(2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine-1-carbonyl)amino]benzamido}benzoate
methyl 2-{3-[(2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine-1-carbonyl)amino]benzamido}benzoate
Compound characteristics
Compound ID: | E867-0327 |
Compound Name: | methyl 2-{3-[(2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine-1-carbonyl)amino]benzamido}benzoate |
Molecular Weight: | 448.5 |
Molecular Formula: | C23 H20 N4 O4 S |
Smiles: | COC(c1ccccc1NC(c1cccc(c1)NC(N1CCSc2c1cccn2)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6032 |
logD: | 3.2243 |
logSw: | -3.8218 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.992 |
InChI Key: | RAMUWNXKSZZPIA-UHFFFAOYSA-N |