[rel-(3aR,7aR)-2-benzyl-5-(cyclopropanesulfonyl)octahydro-3aH-pyrrolo[3,4-c]pyridin-3a-yl]methanol
Chemical Structure Depiction of
[rel-(3aR,7aR)-2-benzyl-5-(cyclopropanesulfonyl)octahydro-3aH-pyrrolo[3,4-c]pyridin-3a-yl]methanol
[rel-(3aR,7aR)-2-benzyl-5-(cyclopropanesulfonyl)octahydro-3aH-pyrrolo[3,4-c]pyridin-3a-yl]methanol
Compound characteristics
| Compound ID: | S858-2416 |
| Compound Name: | [rel-(3aR,7aR)-2-benzyl-5-(cyclopropanesulfonyl)octahydro-3aH-pyrrolo[3,4-c]pyridin-3a-yl]methanol |
| Molecular Weight: | 350.48 |
| Molecular Formula: | C18 H26 N2 O3 S |
| Smiles: | C1CC1S(N1CC[C@H]2CN(Cc3ccccc3)C[C@]2(C1)CO)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5181 |
| logD: | -1.8412 |
| logSw: | -1.9318 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.215 |
| InChI Key: | VVMVPCXZXBZXAI-WMZOPIPTSA-N |