8-(3,5-dimethylphenyl)-3-[(4-fluorophenyl)methyl]-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Chemical Structure Depiction of
8-(3,5-dimethylphenyl)-3-[(4-fluorophenyl)methyl]-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
8-(3,5-dimethylphenyl)-3-[(4-fluorophenyl)methyl]-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | E461-0681 |
| Compound Name: | 8-(3,5-dimethylphenyl)-3-[(4-fluorophenyl)methyl]-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione |
| Molecular Weight: | 419.46 |
| Molecular Formula: | C23 H22 F N5 O2 |
| Smiles: | Cc1cc(C)cc(c1)N1CCn2c3C(N(Cc4ccc(cc4)F)C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7789 |
| logD: | 3.0513 |
| logSw: | -4.5475 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.149 |
| InChI Key: | SCCNGJUUAOXOPK-UHFFFAOYSA-N |