3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one

Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Available: 15 mg
Amount:
mg
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Compound characteristics

Compound ID: K284-3878
Compound Name: 3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Molecular Weight: 502.55
Molecular Formula: C25 H22 N6 O4 S
Smiles: C1CN(CCN1C(c1ccc2C(N(Cc3ccc4c(c3)OCO4)C(Nc2c1)=S)=O)=O)c1ncccn1
Stereo: ACHIRAL
logP: 3.0781
logD: 3.078
logSw: -3.4448
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 1
Polar surface area: 82.704
InChI Key: WMQCRBLQVVBJKD-UHFFFAOYSA-N
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