N-(2-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)-2H-1,3-benzodioxole-5-carboxamide

Chemical Structure Depiction of
N-(2-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)-2H-1,3-benzodioxole-5-carboxamide
Available: 9 mg
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mg
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Compound characteristics

Compound ID: G072-1154
Compound Name: N-(2-{[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)-2H-1,3-benzodioxole-5-carboxamide
Molecular Weight: 466.54
Molecular Formula: C22 H18 N4 O4 S2
Smiles: CCC1=NN2C(=NC(CSc3ccccc3NC(c3ccc4c(c3)OCO4)=O)=CC2=O)S1
Stereo: ACHIRAL
logP: 3.8059
logD: 3.8028
logSw: -3.9961
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 1
Polar surface area: 77.683
InChI Key: MKZPVLZNGSWFBE-UHFFFAOYSA-N
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