1-(4-methylphenyl)-6-(methylsulfanyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(4-methylphenyl)-6-(methylsulfanyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(4-methylphenyl)-6-(methylsulfanyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
Compound ID: | C365-0178 |
Compound Name: | 1-(4-methylphenyl)-6-(methylsulfanyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
Molecular Weight: | 272.33 |
Molecular Formula: | C13 H12 N4 O S |
Smiles: | Cc1ccc(cc1)n1c2c(cn1)C(NC(=N2)SC)=O |
Stereo: | ACHIRAL |
logP: | 2.7481 |
logD: | 2.5859 |
logSw: | -3.3544 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.723 |
InChI Key: | ZWVUDDQMKVIKBP-UHFFFAOYSA-N |