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rel-(3aR,6S,7R,7aS)-N~3~,2-bis(2,3-dimethylcyclohexyl)-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)-N~3~,2-bis(2,3-dimethylcyclohexyl)-1-oxo-N~7~-[4-(propan-2-yl)phenyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
Available: 6 mg
Amount:
mg
Format:
$83.09
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Compound characteristics

Compound ID: C073-3634
Compound Name: rel-(3aR,6S,7R,7aS)-N~3~,2-bis(2,3-dimethylcyclohexyl)-1-oxo-N~7~-[4-(propan-2-yl)phenyl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
Molecular Weight: 575.79
Molecular Formula: C35 H49 N3 O4
Smiles: CC(C)c1ccc(cc1)NC([C@@H]1[C@@H]2C(N(C3CCCC(C)C3C)C(C(NC3CCCC(C)C3C)=O)[C@@]23C=C[C@@H]1O3)=O)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 5.387
logD: 5.3849
logSw: -5.4325
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 2
Polar surface area: 70.874
InChI Key: YSPBMFDMNSEFAH-HGDACWIESA-N
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