methyl N-[(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)acetyl]glycinate
Chemical Structure Depiction of
methyl N-[(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)acetyl]glycinate
methyl N-[(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)acetyl]glycinate
Compound characteristics
| Compound ID: | E961-1058 |
| Compound Name: | methyl N-[(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)acetyl]glycinate |
| Molecular Weight: | 413.43 |
| Molecular Formula: | C20 H23 N5 O5 |
| Smiles: | CCn1c2C(N(Cc3ccccc3)C(N(CC(NCC(=O)OC)=O)c2c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7958 |
| logD: | 0.7958 |
| logSw: | -1.8126 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.665 |
| InChI Key: | XVGYDWVAEFUVOA-UHFFFAOYSA-N |