1-(4-chlorophenyl)-6-{[(naphthalen-1-yl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-6-{[(naphthalen-1-yl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(4-chlorophenyl)-6-{[(naphthalen-1-yl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | G873-0145 |
| Compound Name: | 1-(4-chlorophenyl)-6-{[(naphthalen-1-yl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 418.9 |
| Molecular Formula: | C22 H15 Cl N4 O S |
| Smiles: | C(c1cccc2ccccc12)SC1NC(c2cnn(c3ccc(cc3)[Cl])c2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5366 |
| logD: | 5.5012 |
| logSw: | -6.3274 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.18 |
| InChI Key: | LMXZCAASSVEQEN-UHFFFAOYSA-N |