1-(4-chlorophenyl)-6-[(2-oxo-2-phenylethyl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-6-[(2-oxo-2-phenylethyl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(4-chlorophenyl)-6-[(2-oxo-2-phenylethyl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C365-0168 |
| Compound Name: | 1-(4-chlorophenyl)-6-[(2-oxo-2-phenylethyl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 396.85 |
| Molecular Formula: | C19 H13 Cl N4 O2 S |
| Smiles: | C(C(c1ccccc1)=O)SC1NC(c2cnn(c3ccc(cc3)[Cl])c2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7266 |
| logD: | 3.6809 |
| logSw: | -4.5553 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.699 |
| InChI Key: | RPPYOKDMAGXUMO-UHFFFAOYSA-N |