rel-(3aR,6S,7R,7aS)-2-[(2-chlorophenyl)methyl]-N~3~-cyclohexyl-N~7~-(3,5-dichlorophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide

Chemical Structure Depiction of
rel-(3aR,6S,7R,7aS)-2-[(2-chlorophenyl)methyl]-N~3~-cyclohexyl-N~7~-(3,5-dichlorophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
Available: 602 mg
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mg
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Compound characteristics

Compound ID: C073-3895
Compound Name: rel-(3aR,6S,7R,7aS)-2-[(2-chlorophenyl)methyl]-N~3~-cyclohexyl-N~7~-(3,5-dichlorophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
Molecular Weight: 588.92
Molecular Formula: C29 H28 Cl3 N3 O4
Smiles: C1CCC(CC1)NC(C1[C@@]23C=C[C@@H]([C@H](C(Nc4cc(cc(c4)[Cl])[Cl])=O)[C@@H]2C(N1Cc1ccccc1[Cl])=O)O3)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 6.1913
logD: 4.8469
logSw: -6.2877
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 2
Polar surface area: 71.797
InChI Key: SVTTZHHGJSSUPO-XXVWYLNPSA-N
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