5-(3-chlorophenyl)-6-sulfanyl-2,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
5-(3-chlorophenyl)-6-sulfanyl-2,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
5-(3-chlorophenyl)-6-sulfanyl-2,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | K784-1938 |
| Compound Name: | 5-(3-chlorophenyl)-6-sulfanyl-2,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 278.72 |
| Molecular Formula: | C11 H7 Cl N4 O S |
| Smiles: | c1cc(cc(c1)[Cl])N1C(=Nc2c(c[nH]n2)C1=O)S |
| Stereo: | ACHIRAL |
| logP: | 2.0439 |
| logD: | -2.6222 |
| logSw: | -3.2108 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.204 |
| InChI Key: | KOTVXEYITOQIPY-UHFFFAOYSA-N |