rel-(2R,7aS)-N-[(4-ethoxyphenyl)methyl]-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide

Chemical Structure Depiction of
rel-(2R,7aS)-N-[(4-ethoxyphenyl)methyl]-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Available: 57 mg
Amount:
mg
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Compound characteristics

Compound ID: SC91-0683
Compound Name: rel-(2R,7aS)-N-[(4-ethoxyphenyl)methyl]-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Molecular Weight: 396.46
Molecular Formula: C23 H25 F N2 O3
Smiles: CCOc1ccc(CNC([C@]2(C[C@@H]3CCC(N3C2)=O)c2ccc(cc2)F)=O)cc1
Stereo: RACEMIC MIXTURE (RELATIVE)
logP: 2.8544
logD: 2.8544
logSw: -3.1654
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 49.05
InChI Key: JKZVAKMXVATWQE-WMZHIEFXSA-N
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