(2,5-dimethylfuran-3-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
Chemical Structure Depiction of
(2,5-dimethylfuran-3-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
(2,5-dimethylfuran-3-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
Compound characteristics
| Compound ID: | S997-0721 |
| Compound Name: | (2,5-dimethylfuran-3-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C17 H26 N2 O5 S |
| Smiles: | Cc1cc(C(N2CC[C@]3(CN(C[C@H]3C2)S(C)(=O)=O)COC)=O)c(C)o1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8346 |
| logD: | 0.8346 |
| logSw: | -1.9384 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.427 |
| InChI Key: | UJZFMEROUOLLFO-RHSMWYFYSA-N |