2-(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)-N-(2-ethylphenyl)acetamide
Chemical Structure Depiction of
2-(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)-N-(2-ethylphenyl)acetamide
2-(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)-N-(2-ethylphenyl)acetamide
Compound characteristics
Compound ID: | E961-1018 |
Compound Name: | 2-(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)-N-(2-ethylphenyl)acetamide |
Molecular Weight: | 445.52 |
Molecular Formula: | C25 H27 N5 O3 |
Smiles: | CCc1ccccc1NC(CN1C(N(Cc2ccccc2)C(c2c1c(C)nn2CC)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4202 |
logD: | 3.4202 |
logSw: | -3.351 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.795 |
InChI Key: | NGLZXHAASZDBKB-UHFFFAOYSA-N |