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4-[rel-(3aR,7aR)-3a-(ethoxymethyl)-5-(pyridine-2-carbonyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-2-(trifluoromethyl)benzonitrile

Chemical Structure Depiction of
4-[rel-(3aR,7aR)-3a-(ethoxymethyl)-5-(pyridine-2-carbonyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-2-(trifluoromethyl)benzonitrile
Available: 5 mg
Amount:
mg
Format:
$83.09
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Compound characteristics

Compound ID: S947-0584
Compound Name: 4-[rel-(3aR,7aR)-3a-(ethoxymethyl)-5-(pyridine-2-carbonyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-2-(trifluoromethyl)benzonitrile
Molecular Weight: 458.48
Molecular Formula: C24 H25 F3 N4 O2
Smiles: CCOC[C@@]12CN(CC[C@H]2CN(C1)c1ccc(C#N)c(c1)C(F)(F)F)C(c1ccccn1)=O
Stereo: RELATIVE
logP: 3.0397
logD: 3.0397
logSw: -3.1958
Hydrogen bond acceptors count: 5
Polar surface area: 54.397
InChI Key: YDUINBKMBINMOM-WZONZLPQSA-N
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