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
Available: 304 mg
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mg
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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
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