2-[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]acetamide

Chemical Structure Depiction of
2-[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]acetamide
Available: 250 mg
Amount:
mg
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Compound characteristics

Compound ID: J031-2325
Compound Name: 2-[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]acetamide
Molecular Weight: 362.41
Molecular Formula: C16 H18 N4 O4 S
Smiles: C1COc2ccc(CNC(CSC3NC(C=C(N)N=3)=O)=O)cc2OC1
Stereo: ACHIRAL
logP: -0.3145
logD: -0.3161
logSw: -2.1082
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 4
Polar surface area: 95.307
InChI Key: IRHKAUGCWQZDRQ-UHFFFAOYSA-N
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