8-(hexylamino)-7-{2-hydroxy-3-[(propan-2-yl)oxy]propyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(hexylamino)-7-{2-hydroxy-3-[(propan-2-yl)oxy]propyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
8-(hexylamino)-7-{2-hydroxy-3-[(propan-2-yl)oxy]propyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7706-0405 |
| Compound Name: | 8-(hexylamino)-7-{2-hydroxy-3-[(propan-2-yl)oxy]propyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C18 H31 N5 O4 |
| Smiles: | CCCCCCNc1nc2c(C(NC(N2C)=O)=O)n1CC(COC(C)C)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8441 |
| logD: | 2.8439 |
| logSw: | -2.9062 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.047 |
| InChI Key: | OLTZMIVEOXUBMS-ZDUSSCGKSA-N |