3-({1-ethyl-6-[(furan-2-yl)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-[(furan-2-yl)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-[(furan-2-yl)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: | E961-1180 |
| Compound Name: | 3-({1-ethyl-6-[(furan-2-yl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}methyl)-4-methoxybenzaldehyde |
| Molecular Weight: | 422.44 |
| Molecular Formula: | C22 H22 N4 O5 |
| Smiles: | CCn1c2C(N(Cc3ccco3)C(N(Cc3cc(C=O)ccc3OC)c2c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1942 |
| logD: | 2.1942 |
| logSw: | -2.6 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.882 |
| InChI Key: | CIYITTITUWBOAV-UHFFFAOYSA-N |