6-benzyl-5-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
6-benzyl-5-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
6-benzyl-5-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | E960-0397 |
| Compound Name: | 6-benzyl-5-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 414.89 |
| Molecular Formula: | C20 H16 Cl F N4 O S |
| Smiles: | Cn1c2C(N(Cc3ccccc3)C(=Nc2cn1)SCc1c(cccc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1801 |
| logD: | 4.1801 |
| logSw: | -4.3396 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.898 |
| InChI Key: | GGLDNOSTCXPKDG-UHFFFAOYSA-N |