rel-(4aR,8aS)-6-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,N,1-trimethyl-2,2-dioxooctahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-6-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,N,1-trimethyl-2,2-dioxooctahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide
rel-(4aR,8aS)-6-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,N,1-trimethyl-2,2-dioxooctahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | S808-0394 |
| Compound Name: | rel-(4aR,8aS)-6-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,N,1-trimethyl-2,2-dioxooctahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide |
| Molecular Weight: | 384.5 |
| Molecular Formula: | C17 H28 N4 O4 S |
| Smiles: | [H][C@@]12CCN(Cc3c(C)noc3C)C[C@]1(CCS(N2C)(=O)=O)C(N(C)C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.4587 |
| logD: | -1.4854 |
| logSw: | -1.0236 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.507 |
| InChI Key: | AHCGGTGQADSUBQ-WBVHZDCISA-N |