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-[(4-methoxyphenyl)methyl]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-[(4-methoxyphenyl)methyl]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-[(4-methoxyphenyl)methyl]acetamide
Compound characteristics
Compound ID: | E961-0951 |
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-[(4-methoxyphenyl)methyl]acetamide |
Molecular Weight: | 475.55 |
Molecular Formula: | C26 H29 N5 O4 |
Smiles: | CCn1c2C(N(CCc3ccccc3)C(N(CC(NCc3ccc(cc3)OC)=O)c2c(C)n1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6349 |
logD: | 2.6349 |
logSw: | -2.7235 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.337 |
InChI Key: | MNPMNAJDLDLGBE-UHFFFAOYSA-N |