7-[(3-methylphenyl)methyl]-1-[(oxolan-2-yl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(3-methylphenyl)methyl]-1-[(oxolan-2-yl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
7-[(3-methylphenyl)methyl]-1-[(oxolan-2-yl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V020-0063 |
| Compound Name: | 7-[(3-methylphenyl)methyl]-1-[(oxolan-2-yl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 416.48 |
| Molecular Formula: | C24 H24 N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1cccc(Cn2cnc3c2C(N(CC2CCCO2)C(N3c2ccccc2)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9187 |
| logD: | 2.9187 |
| logSw: | -3.089 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.929 |
| InChI Key: | CNYDSSDYHREJMJ-UHFFFAOYSA-N |