7-(3,3-dimethyl-2-oxobutyl)-3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(3,3-dimethyl-2-oxobutyl)-3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
7-(3,3-dimethyl-2-oxobutyl)-3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V011-6659 |
| Compound Name: | 7-(3,3-dimethyl-2-oxobutyl)-3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 428.46 |
| Molecular Formula: | C22 H25 F N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(C)C(Cn1cnc2c1C(N(CC1CCCO1)C(N2c1ccc(cc1)F)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8936 |
| logD: | 1.8936 |
| logSw: | -2.3193 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.447 |
| InChI Key: | FYLXCLIRRBZASP-UHFFFAOYSA-N |