8-{2-[(adamantan-1-yl)oxy]ethyl}-7-(4-bromophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Chemical Structure Depiction of
8-{2-[(adamantan-1-yl)oxy]ethyl}-7-(4-bromophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
8-{2-[(adamantan-1-yl)oxy]ethyl}-7-(4-bromophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 8013-3674 |
| Compound Name: | 8-{2-[(adamantan-1-yl)oxy]ethyl}-7-(4-bromophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 552.47 |
| Molecular Formula: | C27 H30 Br N5 O3 |
| Smiles: | CN1C(c2c(nc3N(CCOC45CC6CC(CC(C6)C5)C4)C(=Cn23)c2ccc(cc2)[Br])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9409 |
| logD: | 5.9409 |
| logSw: | -5.6031 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.193 |
| InChI Key: | PJSGPAKPDYIHQH-UHFFFAOYSA-N |