9-[(furan-2-yl)methyl]-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-[(furan-2-yl)methyl]-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-[(furan-2-yl)methyl]-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0779 |
| Compound Name: | 9-[(furan-2-yl)methyl]-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 301.3 |
| Molecular Formula: | C14 H15 N5 O3 |
| Smiles: | CN1C(NC(c2c1nc1N(CCCn12)Cc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5744 |
| logD: | 1.5742 |
| logSw: | -2.1187 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.929 |
| InChI Key: | HVAGUUWVWIVBKL-UHFFFAOYSA-N |