7-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-(4-fluorophenyl)-1-[(2-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-(4-fluorophenyl)-1-[(2-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
7-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-(4-fluorophenyl)-1-[(2-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1833 |
| Compound Name: | 7-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-(4-fluorophenyl)-1-[(2-fluorophenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 500.5 |
| Molecular Formula: | C28 H22 F2 N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C(Cn2cnc3c2C(N(Cc2ccccc2F)C(N3c2ccc(cc2)F)=O)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.68 |
| logD: | 4.68 |
| logSw: | -4.441 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.521 |
| InChI Key: | WIRILZWTRAGTEP-UHFFFAOYSA-N |