2-{[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]sulfanyl}-7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-3-carbonitrile

Chemical Structure Depiction of
2-{[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]sulfanyl}-7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-3-carbonitrile
Available: 3 mg
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mg
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Compound characteristics

Compound ID: 8019-3352
Compound Name: 2-{[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]sulfanyl}-7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-3-carbonitrile
Molecular Weight: 400.43
Molecular Formula: C18 H12 N2 O5 S2
Smiles: C1COc2cc(ccc2O1)C(CSc1c(C#N)c2c(C(=CC(N2)=O)O)s1)=O
Stereo: ACHIRAL
logP: 1.5148
logD: -4.4585
logSw: -2.3366
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 2
Polar surface area: 85.525
InChI Key: HQDCBDVAKIHKEQ-UHFFFAOYSA-N
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