1-(4-chlorophenyl)-6-[(1-phenylethyl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-6-[(1-phenylethyl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(4-chlorophenyl)-6-[(1-phenylethyl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
Compound ID: | C365-0111 |
Compound Name: | 1-(4-chlorophenyl)-6-[(1-phenylethyl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
Molecular Weight: | 382.87 |
Molecular Formula: | C19 H15 Cl N4 O S |
Smiles: | CC(c1ccccc1)SC1NC(c2cnn(c3ccc(cc3)[Cl])c2N=1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.0393 |
logD: | 5.0251 |
logSw: | -5.0867 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.452 |
InChI Key: | MGIHNNVOMBQUEQ-LBPRGKRZSA-N |