7-[2-(3,4-difluorophenyl)-2-oxoethyl]-3-(4-fluorophenyl)-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[2-(3,4-difluorophenyl)-2-oxoethyl]-3-(4-fluorophenyl)-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
7-[2-(3,4-difluorophenyl)-2-oxoethyl]-3-(4-fluorophenyl)-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1456 |
| Compound Name: | 7-[2-(3,4-difluorophenyl)-2-oxoethyl]-3-(4-fluorophenyl)-1-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 470.45 |
| Molecular Formula: | C24 H21 F3 N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CCN1C(c2c(ncn2CC(c2ccc(c(c2)F)F)=O)N(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1246 |
| logD: | 4.1246 |
| logSw: | -4.1589 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.771 |
| InChI Key: | BAUIPGVLSKRUHW-UHFFFAOYSA-N |