(3,5-dimethyl-1,2-oxazol-4-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
Chemical Structure Depiction of
(3,5-dimethyl-1,2-oxazol-4-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
(3,5-dimethyl-1,2-oxazol-4-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
Compound characteristics
| Compound ID: | S997-0800 |
| Compound Name: | (3,5-dimethyl-1,2-oxazol-4-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone |
| Molecular Weight: | 371.45 |
| Molecular Formula: | C16 H25 N3 O5 S |
| Smiles: | Cc1c(C(N2CC[C@]3(CN(C[C@H]3C2)S(C)(=O)=O)COC)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.0192 |
| logD: | -0.0192 |
| logSw: | -1.2623 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.718 |
| InChI Key: | OTBIFUCWHWOPPT-CZUORRHYSA-N |