rel-(4aR,8aS)-6-[(3-fluoropyridin-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-fluoropyridin-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-fluoropyridin-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: | S808-0352 |
| Compound Name: | rel-(4aR,8aS)-6-[(3-fluoropyridin-4-yl)methyl]-N,N,1-trimethyl-2,2-dioxooctahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide |
| Molecular Weight: | 384.47 |
| Molecular Formula: | C17 H25 F N4 O3 S |
| Smiles: | [H][C@@]12CCN(Cc3ccncc3F)C[C@]1(CCS(N2C)(=O)=O)C(N(C)C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.3398 |
| logD: | -0.3438 |
| logSw: | -1.3984 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.987 |
| InChI Key: | WCJIGYILSDKVGZ-WBVHZDCISA-N |