1-[rel-(3aR,7aS)-3a-(hydroxymethyl)-2-(4-methylbenzene-1-sulfonyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]ethan-1-one
					Chemical Structure Depiction of
1-[rel-(3aR,7aS)-3a-(hydroxymethyl)-2-(4-methylbenzene-1-sulfonyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]ethan-1-one
			1-[rel-(3aR,7aS)-3a-(hydroxymethyl)-2-(4-methylbenzene-1-sulfonyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | S858-3712 | 
| Compound Name: | 1-[rel-(3aR,7aS)-3a-(hydroxymethyl)-2-(4-methylbenzene-1-sulfonyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]ethan-1-one | 
| Molecular Weight: | 352.45 | 
| Molecular Formula: | C17 H24 N2 O4 S | 
| Smiles: | CC(N1CC[C@H]2CN(C[C@]2(C1)CO)S(c1ccc(C)cc1)(=O)=O)=O | 
| Stereo: | RACEMIC MIXTURE (RELATIVE) | 
| logP: | 1.1903 | 
| logD: | 1.1903 | 
| logSw: | -2.2821 | 
| Hydrogen bond acceptors count: | 8 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 66.347 | 
| InChI Key: | KIIPBIASRNANQZ-NVXWUHKLSA-N | 
 
				 
				