2-({2-ethyl-6-[(4-methylphenyl)methyl]-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-({2-ethyl-6-[(4-methylphenyl)methyl]-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(2-methoxyphenyl)acetamide
2-({2-ethyl-6-[(4-methylphenyl)methyl]-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | G020-0011 |
| Compound Name: | 2-({2-ethyl-6-[(4-methylphenyl)methyl]-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(2-methoxyphenyl)acetamide |
| Molecular Weight: | 463.56 |
| Molecular Formula: | C24 H25 N5 O3 S |
| Smiles: | CCn1cc2c(C(N(Cc3ccc(C)cc3)C(=N2)SCC(Nc2ccccc2OC)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3311 |
| logD: | 3.3311 |
| logSw: | -3.5428 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.992 |
| InChI Key: | XMQBSHLFCGMKFK-UHFFFAOYSA-N |