rel-(4aR,8aS)-N,N,1-trimethyl-2,2-dioxo-6-(thiophene-3-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-N,N,1-trimethyl-2,2-dioxo-6-(thiophene-3-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide
rel-(4aR,8aS)-N,N,1-trimethyl-2,2-dioxo-6-(thiophene-3-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | S808-0345 |
| Compound Name: | rel-(4aR,8aS)-N,N,1-trimethyl-2,2-dioxo-6-(thiophene-3-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide |
| Molecular Weight: | 385.5 |
| Molecular Formula: | C16 H23 N3 O4 S2 |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCS(N2C)(=O)=O)C(N(C)C)=O)C(c1ccsc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.3225 |
| logD: | -0.3225 |
| logSw: | -1.8241 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.403 |
| InChI Key: | AABODMRQGGJVQH-CJNGLKHVSA-N |