1-[rel-(3aR,7aS)-3a-(hydroxymethyl)-5-(propan-2-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-3-(4-methoxyphenyl)propan-1-one
					Chemical Structure Depiction of
1-[rel-(3aR,7aS)-3a-(hydroxymethyl)-5-(propan-2-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-3-(4-methoxyphenyl)propan-1-one
			1-[rel-(3aR,7aS)-3a-(hydroxymethyl)-5-(propan-2-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-3-(4-methoxyphenyl)propan-1-one
Compound characteristics
| Compound ID: | S996-0738 | 
| Compound Name: | 1-[rel-(3aR,7aS)-3a-(hydroxymethyl)-5-(propan-2-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-3-(4-methoxyphenyl)propan-1-one | 
| Molecular Weight: | 360.5 | 
| Molecular Formula: | C21 H32 N2 O3 | 
| Smiles: | CC(C)N1CC[C@@H]2CN(C[C@@]2(C1)CO)C(CCc1ccc(cc1)OC)=O | 
| Stereo: | RACEMIC MIXTURE (RELATIVE) | 
| logP: | 2.1911 | 
| logD: | -1.1407 | 
| logSw: | -2.175 | 
| Hydrogen bond acceptors count: | 5 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 44.969 | 
| InChI Key: | JWNUJFUXQOSHFX-WIYYLYMNSA-N | 
 
				 
				