6-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1-(2-hydroxyethyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
6-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1-(2-hydroxyethyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
6-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1-(2-hydroxyethyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | F248-0160 |
| Compound Name: | 6-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1-(2-hydroxyethyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 371.24 |
| Molecular Formula: | C14 H12 Cl2 N4 O2 S |
| Smiles: | C(CO)n1c2c(cn1)C(NC(=N2)SCc1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6601 |
| logD: | 2.6413 |
| logSw: | -3.5134 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.221 |
| InChI Key: | SPJMAWWFNUNQAP-UHFFFAOYSA-N |