7-(4-bromophenyl)-8-[3-(hexyloxy)phenyl]-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Chemical Structure Depiction of
7-(4-bromophenyl)-8-[3-(hexyloxy)phenyl]-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
7-(4-bromophenyl)-8-[3-(hexyloxy)phenyl]-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 8012-7552 |
| Compound Name: | 7-(4-bromophenyl)-8-[3-(hexyloxy)phenyl]-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 550.45 |
| Molecular Formula: | C27 H28 Br N5 O3 |
| Smiles: | CCCCCCOc1cccc(c1)N1C(=Cn2c3C(N(C)C(N(C)c3nc12)=O)=O)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 7.0423 |
| logD: | 7.0423 |
| logSw: | -5.6851 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.76 |
| InChI Key: | IYXWLNBPBXSPIS-UHFFFAOYSA-N |