rel-(4aR,8aS)-1-methyl-6-(phenoxyacetyl)-4a-(pyrrolidine-1-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-2,2(1H)-dione
Chemical Structure Depiction of
rel-(4aR,8aS)-1-methyl-6-(phenoxyacetyl)-4a-(pyrrolidine-1-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-2,2(1H)-dione
rel-(4aR,8aS)-1-methyl-6-(phenoxyacetyl)-4a-(pyrrolidine-1-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-2,2(1H)-dione
Compound characteristics
| Compound ID: | S808-0706 |
| Compound Name: | rel-(4aR,8aS)-1-methyl-6-(phenoxyacetyl)-4a-(pyrrolidine-1-carbonyl)octahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-2,2(1H)-dione |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C21 H29 N3 O5 S |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCS(N2C)(=O)=O)C(N1CCCC1)=O)C(COc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8204 |
| logD: | 0.8204 |
| logSw: | -1.986 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.37 |
| InChI Key: | GPXQEZDHXHFVBR-NQIIRXRSSA-N |