9-[(furan-2-yl)methyl]-1-methyl-3-(2-oxo-2-phenylethyl)-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-3-(2-oxo-2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-[(furan-2-yl)methyl]-1-methyl-3-(2-oxo-2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0793 |
| Compound Name: | 9-[(furan-2-yl)methyl]-1-methyl-3-(2-oxo-2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 419.44 |
| Molecular Formula: | C22 H21 N5 O4 |
| Smiles: | CN1C(N(CC(c2ccccc2)=O)C(c2c1nc1N(CCCn12)Cc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5568 |
| logD: | 2.5554 |
| logSw: | -2.5372 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.224 |
| InChI Key: | VQMKZFCWJAUIIF-UHFFFAOYSA-N |