6-benzyl-1-ethyl-3-methyl-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Chemical Structure Depiction of
6-benzyl-1-ethyl-3-methyl-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
6-benzyl-1-ethyl-3-methyl-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Compound characteristics
| Compound ID: | E961-1010 |
| Compound Name: | 6-benzyl-1-ethyl-3-methyl-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C23 H29 N5 O3 |
| Smiles: | CCn1c2C(N(Cc3ccccc3)C(N(CC(N3CCC(C)CC3)=O)c2c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1794 |
| logD: | 2.1794 |
| logSw: | -2.3004 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.736 |
| InChI Key: | XIULFNUWOFRQGN-UHFFFAOYSA-N |