2-[1-ethyl-3-methyl-5,7-dioxo-6-(2-phenylethyl)-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[1-ethyl-3-methyl-5,7-dioxo-6-(2-phenylethyl)-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
2-[1-ethyl-3-methyl-5,7-dioxo-6-(2-phenylethyl)-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | E961-0912 |
| Compound Name: | 2-[1-ethyl-3-methyl-5,7-dioxo-6-(2-phenylethyl)-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl]-N-[2-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 499.49 |
| Molecular Formula: | C25 H24 F3 N5 O3 |
| Smiles: | CCn1c2C(N(CCc3ccccc3)C(N(CC(Nc3ccccc3C(F)(F)F)=O)c2c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5904 |
| logD: | 3.5904 |
| logSw: | -3.8001 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.773 |
| InChI Key: | CAADYJKDOJFRNI-UHFFFAOYSA-N |