6-benzyl-2-ethyl-5-{[(2-methylphenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
6-benzyl-2-ethyl-5-{[(2-methylphenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
6-benzyl-2-ethyl-5-{[(2-methylphenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | G020-0238 |
| Compound Name: | 6-benzyl-2-ethyl-5-{[(2-methylphenyl)methyl]sulfanyl}-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 390.51 |
| Molecular Formula: | C22 H22 N4 O S |
| Smiles: | CCn1cc2c(C(N(Cc3ccccc3)C(=N2)SCc2ccccc2C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5568 |
| logD: | 4.5568 |
| logSw: | -4.2057 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.91 |
| InChI Key: | XCSSHIQHGUEMAL-UHFFFAOYSA-N |