2-(6-benzyl-2-ethyl-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-(6-benzyl-2-ethyl-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)-N-(2-ethyl-6-methylphenyl)acetamide
2-(6-benzyl-2-ethyl-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: | L681-0143 |
| Compound Name: | 2-(6-benzyl-2-ethyl-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)-N-(2-ethyl-6-methylphenyl)acetamide |
| Molecular Weight: | 445.52 |
| Molecular Formula: | C25 H27 N5 O3 |
| Smiles: | CCc1cccc(C)c1NC(CN1C(N(Cc2ccccc2)C(c2c1cn(CC)n2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4551 |
| logD: | 3.4551 |
| logSw: | -3.3221 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.16 |
| InChI Key: | OTUNKUXXRGFJKG-UHFFFAOYSA-N |