3-({1-ethyl-6-[(4-fluorophenyl)methyl]-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-({1-ethyl-6-[(4-fluorophenyl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}methyl)-4-methoxybenzaldehyde
3-({1-ethyl-6-[(4-fluorophenyl)methyl]-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: | E961-1088 |
| Compound Name: | 3-({1-ethyl-6-[(4-fluorophenyl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}methyl)-4-methoxybenzaldehyde |
| Molecular Weight: | 450.47 |
| Molecular Formula: | C24 H23 F N4 O4 |
| Smiles: | CCn1c2C(N(Cc3ccc(cc3)F)C(N(Cc3cc(C=O)ccc3OC)c2c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9698 |
| logD: | 2.9698 |
| logSw: | -2.9987 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.133 |
| InChI Key: | HWGLYZLAALEQCJ-UHFFFAOYSA-N |