2-({6-[(2H-1,3-benzodioxol-5-yl)methyl]-1-ethyl-3-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(propan-2-yl)acetamide

Chemical Structure Depiction of
2-({6-[(2H-1,3-benzodioxol-5-yl)methyl]-1-ethyl-3-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(propan-2-yl)acetamide
Available: 121 mg
Amount:
mg
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Compound characteristics

Compound ID: E960-1125
Compound Name: 2-({6-[(2H-1,3-benzodioxol-5-yl)methyl]-1-ethyl-3-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(propan-2-yl)acetamide
Molecular Weight: 443.52
Molecular Formula: C21 H25 N5 O4 S
Smiles: CCn1c2C(N(Cc3ccc4c(c3)OCO4)C(=Nc2c(C)n1)SCC(NC(C)C)=O)=O
Stereo: ACHIRAL
logP: 1.8845
logD: 1.8845
logSw: -2.7313
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 78.271
InChI Key: BQEHKVFECISCBJ-UHFFFAOYSA-N
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