6-butyl-1,3-dimethyl-7-phenyl-8-[3-(trifluoromethyl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Chemical Structure Depiction of
6-butyl-1,3-dimethyl-7-phenyl-8-[3-(trifluoromethyl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
6-butyl-1,3-dimethyl-7-phenyl-8-[3-(trifluoromethyl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 8019-7636 |
| Compound Name: | 6-butyl-1,3-dimethyl-7-phenyl-8-[3-(trifluoromethyl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 495.5 |
| Molecular Formula: | C26 H24 F3 N5 O2 |
| Smiles: | CCCCC1=C(c2ccccc2)N(c2cccc(c2)C(F)(F)F)c2nc3c(C(N(C)C(N3C)=O)=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 6.2329 |
| logD: | 6.2329 |
| logSw: | -5.5133 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.975 |
| InChI Key: | KHUBAWMHWTUPLD-UHFFFAOYSA-N |