methyl 2-(2-{4-[(2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine-1-carbonyl)amino]phenyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-{4-[(2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine-1-carbonyl)amino]phenyl}acetamido)benzoate
methyl 2-(2-{4-[(2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine-1-carbonyl)amino]phenyl}acetamido)benzoate
Compound characteristics
| Compound ID: | E867-1029 |
| Compound Name: | methyl 2-(2-{4-[(2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine-1-carbonyl)amino]phenyl}acetamido)benzoate |
| Molecular Weight: | 462.53 |
| Molecular Formula: | C24 H22 N4 O4 S |
| Smiles: | COC(c1ccccc1NC(Cc1ccc(cc1)NC(N1CCSc2c1cccn2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.993 |
| logD: | 2.9277 |
| logSw: | -3.6284 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.778 |
| InChI Key: | AEVYJCVAYOUDGK-UHFFFAOYSA-N |