1-(4-chlorophenyl)-6-{[(2-chlorophenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-6-{[(2-chlorophenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(4-chlorophenyl)-6-{[(2-chlorophenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C365-0108 |
| Compound Name: | 1-(4-chlorophenyl)-6-{[(2-chlorophenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 403.29 |
| Molecular Formula: | C18 H12 Cl2 N4 O S |
| Smiles: | C(c1ccccc1[Cl])SC1NC(c2cnn(c3ccc(cc3)[Cl])c2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9653 |
| logD: | 4.9383 |
| logSw: | -5.0484 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.452 |
| InChI Key: | YYWSPLHNVNRRQI-UHFFFAOYSA-N |