2-[(6-benzyl-2-ethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl]-N-(3,4-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-[(6-benzyl-2-ethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl]-N-(3,4-dimethylphenyl)acetamide
2-[(6-benzyl-2-ethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl]-N-(3,4-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | G020-0209 |
| Compound Name: | 2-[(6-benzyl-2-ethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl]-N-(3,4-dimethylphenyl)acetamide |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C24 H25 N5 O2 S |
| Smiles: | CCn1cc2c(C(N(Cc3ccccc3)C(=N2)SCC(Nc2ccc(C)c(C)c2)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.142 |
| logD: | 4.142 |
| logSw: | -3.9851 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.06 |
| InChI Key: | FMQUUQFHOWHODJ-UHFFFAOYSA-N |