2-({6-[(4-chlorophenyl)methyl]-2-ethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(2,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-({6-[(4-chlorophenyl)methyl]-2-ethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(2,4-dimethoxyphenyl)acetamide
2-({6-[(4-chlorophenyl)methyl]-2-ethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(2,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C200-4179 |
| Compound Name: | 2-({6-[(4-chlorophenyl)methyl]-2-ethyl-7-oxo-6,7-dihydro-2H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-(2,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 514 |
| Molecular Formula: | C24 H24 Cl N5 O4 S |
| Smiles: | CCn1cc2c(C(N(Cc3ccc(cc3)[Cl])C(=N2)SCC(Nc2ccc(cc2OC)OC)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4945 |
| logD: | 3.4945 |
| logSw: | -3.922 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.536 |
| InChI Key: | LVQRWEFGKMWJOF-UHFFFAOYSA-N |