9-cyclohexyl-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-cyclohexyl-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-cyclohexyl-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0855 |
| Compound Name: | 9-cyclohexyl-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 414.55 |
| Molecular Formula: | C22 H34 N6 O2 |
| Smiles: | CN1C(N(CCN2CCCCC2)C(c2c1nc1N(CCCn12)C1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.224 |
| logD: | 1.0711 |
| logSw: | -3.1285 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.577 |
| InChI Key: | KRBMDSVXIFHFCO-UHFFFAOYSA-N |