rel-(3aR,6S,7R,7aS)-2-(3-methylbutyl)-N~3~-(2-methylcyclohexyl)-1-oxo-N~7~-[4-(propan-2-yl)phenyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
					Chemical Structure Depiction of
rel-(3aR,6S,7R,7aS)-2-(3-methylbutyl)-N~3~-(2-methylcyclohexyl)-1-oxo-N~7~-[4-(propan-2-yl)phenyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
			rel-(3aR,6S,7R,7aS)-2-(3-methylbutyl)-N~3~-(2-methylcyclohexyl)-1-oxo-N~7~-[4-(propan-2-yl)phenyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
Compound characteristics
| Compound ID: | C073-6215 | 
| Compound Name: | rel-(3aR,6S,7R,7aS)-2-(3-methylbutyl)-N~3~-(2-methylcyclohexyl)-1-oxo-N~7~-[4-(propan-2-yl)phenyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide | 
| Molecular Weight: | 521.7 | 
| Molecular Formula: | C31 H43 N3 O4 | 
| Smiles: | CC(C)CCN1C(C(NC2CCCCC2C)=O)[C@@]23C=C[C@@H]([C@H](C(Nc4ccc(cc4)C(C)C)=O)[C@@H]2C1=O)O3 | 
| Stereo: | MIXTURE OF STEREOISOMERS | 
| logP: | 5.7089 | 
| logD: | 5.7068 | 
| logSw: | -5.4869 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 72.437 | 
| InChI Key: | WXDIKMDMUKNGDG-SEKUATBWSA-N | 
 
				 
				