rel-(4aR,8aS)-1-methyl-4a-(pyrrolidine-1-carbonyl)-6-(thiophene-2-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-2,2(1H)-dione
Chemical Structure Depiction of
rel-(4aR,8aS)-1-methyl-4a-(pyrrolidine-1-carbonyl)-6-(thiophene-2-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-2,2(1H)-dione
rel-(4aR,8aS)-1-methyl-4a-(pyrrolidine-1-carbonyl)-6-(thiophene-2-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-2,2(1H)-dione
Compound characteristics
| Compound ID: | S808-0655 |
| Compound Name: | rel-(4aR,8aS)-1-methyl-4a-(pyrrolidine-1-carbonyl)-6-(thiophene-2-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-2,2(1H)-dione |
| Molecular Weight: | 411.54 |
| Molecular Formula: | C18 H25 N3 O4 S2 |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCS(N2C)(=O)=O)C(N1CCCC1)=O)C(c1cccs1)=O |
| Stereo: | RELATIVE |
| logP: | 1.1159 |
| logD: | 1.1159 |
| logSw: | -2.2034 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.417 |
| InChI Key: | MQDCWGVFWBZUHR-QAPCUYQASA-N |