4-[6-({2-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-1-yl]benzene-1-sulfonamide

Chemical Structure Depiction of
4-[6-({2-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-1-yl]benzene-1-sulfonamide
Available: 369 mg
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mg
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Compound characteristics

Compound ID: C099-0756
Compound Name: 4-[6-({2-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-1-yl]benzene-1-sulfonamide
Molecular Weight: 675.74
Molecular Formula: C31 H29 N7 O7 S2
Smiles: COc1ccc(cc1)C1CC(c2cccc(c2OC)OC)N(C(CSC2NC(c3cnn(c4ccc(cc4)S(N)(=O)=O)c3N=2)=O)=O)N=1
Stereo: RACEMIC MIXTURE
logP: 3.3952
logD: 3.3322
logSw: -3.9126
Hydrogen bond acceptors count: 16
Hydrogen bond donors count: 3
Polar surface area: 148.566
InChI Key: VVEHFIDGVUCNGA-VWLOTQADSA-N
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