2-{[3,6-bis(2,6-dimethylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide

Chemical Structure Depiction of
2-{[3,6-bis(2,6-dimethylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Available: 103 mg
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mg
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Compound characteristics

Compound ID: K286-0038
Compound Name: 2-{[3,6-bis(2,6-dimethylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Molecular Weight: 626.74
Molecular Formula: C30 H25 F3 N4 O2 S3
Smiles: Cc1cccc(C)c1N1C(=NC2=C(C1=O)SC(N2c1c(C)cccc1C)=S)SCC(Nc1cccc(c1)C(F)(F)F)=O
Stereo: ACHIRAL
logP: 7.5235
logD: 7.5233
logSw: -5.7126
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 48.9
InChI Key: GPURFVAZBUPRFX-UHFFFAOYSA-N
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