rel-(4aR,8aS)-1-(2-methoxyethyl)-4a-(morpholine-4-carbonyl)-2,2-dioxo-N-(propan-2-yl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-6(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-1-(2-methoxyethyl)-4a-(morpholine-4-carbonyl)-2,2-dioxo-N-(propan-2-yl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-6(2H)-carboxamide
rel-(4aR,8aS)-1-(2-methoxyethyl)-4a-(morpholine-4-carbonyl)-2,2-dioxo-N-(propan-2-yl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-6(2H)-carboxamide
Compound characteristics
| Compound ID: | S808-0254 |
| Compound Name: | rel-(4aR,8aS)-1-(2-methoxyethyl)-4a-(morpholine-4-carbonyl)-2,2-dioxo-N-(propan-2-yl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-6(2H)-carboxamide |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C19 H34 N4 O6 S |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCS(N2CCOC)(=O)=O)C(N1CCOCC1)=O)C(NC(C)C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.4008 |
| logD: | -0.4008 |
| logSw: | -1.6748 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.646 |
| InChI Key: | LJVBJPIKEKLNCG-APWZRJJASA-N |