N-(2,4-dimethoxyphenyl)-2-{[4-imino-3-methyl-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2-{[4-imino-3-methyl-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
N-(2,4-dimethoxyphenyl)-2-{[4-imino-3-methyl-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | K898-1014 |
Compound Name: | N-(2,4-dimethoxyphenyl)-2-{[4-imino-3-methyl-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide |
Molecular Weight: | 464.55 |
Molecular Formula: | C23 H24 N6 O3 S |
Smiles: | Cc1ccc(cc1)N1C(c2c(C)n[nH]c2N=C1SCC(Nc1ccc(cc1OC)OC)=O)=N |
Stereo: | ACHIRAL |
logP: | 2.9122 |
logD: | -1.3564 |
logSw: | -3.4645 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 90.394 |
InChI Key: | YFUMYYFNOGYCID-UHFFFAOYSA-N |