rel-(1R,2R,3aS)-1-(4-methoxybenzoyl)-2-(4-methoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile

Chemical Structure Depiction of
rel-(1R,2R,3aS)-1-(4-methoxybenzoyl)-2-(4-methoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Available: 43 mg
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mg
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Compound characteristics

Compound ID: 8006-8543
Compound Name: rel-(1R,2R,3aS)-1-(4-methoxybenzoyl)-2-(4-methoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Molecular Weight: 461.52
Molecular Formula: C29 H23 N3 O3
Smiles: [H][C@@]12C=Cc3ccccc3N2[C@H](C(c2ccc(cc2)OC)=O)[C@@H](c2ccc(cc2)OC)C1(C#N)C#N
Stereo: RACEMIC MIXTURE (RELATIVE)
logP: 4.9537
logD: 4.8266
logSw: -4.642
Hydrogen bond acceptors count: 6
Polar surface area: 64.899
InChI Key: SGTCURCKMFXAGO-VJGNERBWSA-N
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