3-(2,4-difluorophenyl)-1-ethyl-7-{[4-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2,4-difluorophenyl)-1-ethyl-7-{[4-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione
3-(2,4-difluorophenyl)-1-ethyl-7-{[4-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1266 |
| Compound Name: | 3-(2,4-difluorophenyl)-1-ethyl-7-{[4-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 450.37 |
| Molecular Formula: | C21 H15 F5 N4 O2 |
| Salt: | not_available |
| Smiles: | CCN1C(c2c(ncn2Cc2ccc(cc2)C(F)(F)F)N(C1=O)c1ccc(cc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6064 |
| logD: | 3.6064 |
| logSw: | -3.8566 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.97 |
| InChI Key: | OMTFBBIKHKCFBZ-UHFFFAOYSA-N |