rel-(3aR,6S,7R,7aS)-N~3~-cyclohexyl-N~7~-(4-methoxyphenyl)-1-oxo-2-[(oxolan-2-yl)methyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide

Chemical Structure Depiction of
rel-(3aR,6S,7R,7aS)-N~3~-cyclohexyl-N~7~-(4-methoxyphenyl)-1-oxo-2-[(oxolan-2-yl)methyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
Available: 202 mg
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mg
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Compound characteristics

Compound ID: C073-4129
Compound Name: rel-(3aR,6S,7R,7aS)-N~3~-cyclohexyl-N~7~-(4-methoxyphenyl)-1-oxo-2-[(oxolan-2-yl)methyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
Molecular Weight: 509.6
Molecular Formula: C28 H35 N3 O6
Smiles: COc1ccc(cc1)NC([C@@H]1[C@@H]2C(N(CC3CCCO3)C(C(NC3CCCCC3)=O)[C@@]23C=C[C@@H]1O3)=O)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 2.5812
logD: 2.5778
logSw: -3.1108
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 2
Polar surface area: 87.995
InChI Key: BQWFLNGKNSDJHQ-BDGALHOZSA-N
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