2-{2-ethyl-6-[(4-fluorophenyl)methyl]-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}-N-(2-ethyl-6-methylphenyl)acetamide
Chemical Structure Depiction of
2-{2-ethyl-6-[(4-fluorophenyl)methyl]-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}-N-(2-ethyl-6-methylphenyl)acetamide
2-{2-ethyl-6-[(4-fluorophenyl)methyl]-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}-N-(2-ethyl-6-methylphenyl)acetamide
Compound characteristics
| Compound ID: | L681-0062 |
| Compound Name: | 2-{2-ethyl-6-[(4-fluorophenyl)methyl]-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}-N-(2-ethyl-6-methylphenyl)acetamide |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C25 H26 F N5 O3 |
| Smiles: | CCc1cccc(C)c1NC(CN1C(N(Cc2ccc(cc2)F)C(c2c1cn(CC)n2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4842 |
| logD: | 3.4842 |
| logSw: | -3.3644 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.16 |
| InChI Key: | QQUBJBCRKCCMOI-UHFFFAOYSA-N |