8-{2-[(adamantan-1-yl)oxy]ethyl}-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Chemical Structure Depiction of
8-{2-[(adamantan-1-yl)oxy]ethyl}-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
8-{2-[(adamantan-1-yl)oxy]ethyl}-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 8013-2400 |
| Compound Name: | 8-{2-[(adamantan-1-yl)oxy]ethyl}-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C27 H31 N5 O3 |
| Smiles: | CN1C(c2c(nc3N(CCOC45CC6CC(CC(C6)C5)C4)C(=Cn23)c2ccccc2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0019 |
| logD: | 5.0019 |
| logSw: | -4.6653 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.193 |
| InChI Key: | PXKWAOOBLRBFKV-UHFFFAOYSA-N |