2-{[1-(3,4-dimethylphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide

Chemical Structure Depiction of
2-{[1-(3,4-dimethylphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Available: 239 mg
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mg
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Compound characteristics

Compound ID: C365-0302
Compound Name: 2-{[1-(3,4-dimethylphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Molecular Weight: 473.48
Molecular Formula: C22 H18 F3 N5 O2 S
Smiles: Cc1ccc(cc1C)n1c2c(cn1)C(NC(=N2)SCC(Nc1ccccc1C(F)(F)F)=O)=O
Stereo: ACHIRAL
logP: 4.7529
logD: 4.6899
logSw: -4.3771
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 2
Polar surface area: 70.903
InChI Key: KKRXRMSHKWQPIJ-UHFFFAOYSA-N
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