3-[(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)methyl]-4-methoxybenzaldehyde
Chemical Structure Depiction of
3-[(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)methyl]-4-methoxybenzaldehyde
3-[(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)methyl]-4-methoxybenzaldehyde
Compound characteristics
| Compound ID: | E961-0987 |
| Compound Name: | 3-[(6-benzyl-1-ethyl-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl)methyl]-4-methoxybenzaldehyde |
| Molecular Weight: | 432.48 |
| Molecular Formula: | C24 H24 N4 O4 |
| Smiles: | CCn1c2C(N(Cc3ccccc3)C(N(Cc3cc(C=O)ccc3OC)c2c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9408 |
| logD: | 2.9408 |
| logSw: | -3.1219 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.133 |
| InChI Key: | FTSZERZAVXPSJR-UHFFFAOYSA-N |