(furan-3-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
Chemical Structure Depiction of
(furan-3-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
(furan-3-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
Compound characteristics
| Compound ID: | S997-0719 |
| Compound Name: | (furan-3-yl)[rel-(3aR,7aS)-2-(methanesulfonyl)-7a-(methoxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone |
| Molecular Weight: | 342.41 |
| Molecular Formula: | C15 H22 N2 O5 S |
| Smiles: | COC[C@]12CCN(C[C@@H]2CN(C1)S(C)(=O)=O)C(c1ccoc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1659 |
| logD: | 0.1659 |
| logSw: | -1.9847 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.483 |
| InChI Key: | VPLNSRRNKVEKTD-UKRRQHHQSA-N |