7-(adamantan-1-yl)-8-butyl-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Chemical Structure Depiction of
7-(adamantan-1-yl)-8-butyl-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
7-(adamantan-1-yl)-8-butyl-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Compound characteristics
| Compound ID: | 8012-8990 |
| Compound Name: | 7-(adamantan-1-yl)-8-butyl-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C23 H31 N5 O2 |
| Smiles: | CCCCN1C(=Cn2c3C(N(C)C(N(C)c3nc12)=O)=O)C12CC3CC(CC(C3)C2)C1 |
| Stereo: | ACHIRAL |
| logP: | 5.2892 |
| logD: | 5.2891 |
| logSw: | -5.0389 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.237 |
| InChI Key: | CIPHDEYTIHJCRR-UHFFFAOYSA-N |