dimethyl 5-{[2-(2,5-dimethoxyanilino)-4-oxo-5,6-dihydro-4H-1,3-thiazine-6-carbonyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[2-(2,5-dimethoxyanilino)-4-oxo-5,6-dihydro-4H-1,3-thiazine-6-carbonyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[2-(2,5-dimethoxyanilino)-4-oxo-5,6-dihydro-4H-1,3-thiazine-6-carbonyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y020-5917 |
| Compound Name: | dimethyl 5-{[2-(2,5-dimethoxyanilino)-4-oxo-5,6-dihydro-4H-1,3-thiazine-6-carbonyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 501.51 |
| Molecular Formula: | C23 H23 N3 O8 S |
| Smiles: | COC(c1cc(cc(c1)NC(C1CC(N=C(Nc2cc(ccc2OC)OC)S1)=O)=O)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2957 |
| logD: | 3.122 |
| logSw: | -3.637 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.388 |
| InChI Key: | CRSCQZBANANOIQ-SFHVURJKSA-N |