8-[2-(adamantan-1-yl)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)ethyl]-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
8-[2-(adamantan-1-yl)ethyl]-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 8012-6867 |
| Compound Name: | 8-[2-(adamantan-1-yl)ethyl]-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 457.58 |
| Molecular Formula: | C27 H31 N5 O2 |
| Smiles: | CN1C(c2c(nc3N(CCC45CC6CC(CC(C6)C5)C4)C(=Cn23)c2ccccc2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.613 |
| logD: | 5.613 |
| logSw: | -5.572 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.966 |
| InChI Key: | MYLYKJABTGPXMA-UHFFFAOYSA-N |