2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide
Chemical Structure Depiction of
2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide
2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide
Compound characteristics
Compound ID: | 6481-5152 |
Compound Name: | 2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide |
Molecular Weight: | 461.52 |
Molecular Formula: | C21 H15 N7 O2 S2 |
Smiles: | C(C(Nc1nc(c2ccccc2)ns1)=O)SC1=Nc2c(cn[nH]2)C(N1c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 3.2898 |
logD: | 3.2886 |
logSw: | -3.562 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 93.163 |
InChI Key: | VOVIREMRKFDXMP-UHFFFAOYSA-N |