8-{2-[(adamantan-1-yl)amino]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)amino]ethyl}-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
8-{2-[(adamantan-1-yl)amino]ethyl}-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 8013-6486 |
| Compound Name: | 8-{2-[(adamantan-1-yl)amino]ethyl}-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 472.59 |
| Molecular Formula: | C27 H32 N6 O2 |
| Smiles: | CN1C(c2c(nc3N(CCNC45CC6CC(CC(C6)C5)C4)C(=Cn23)c2ccccc2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4724 |
| logD: | 3.9468 |
| logSw: | -4.1971 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.298 |
| InChI Key: | OWZDRCICARLWME-UHFFFAOYSA-N |