8-(ethylamino)-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(ethylamino)-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
8-(ethylamino)-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 4555-0203 |
| Compound Name: | 8-(ethylamino)-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 293.37 |
| Molecular Formula: | C14 H23 N5 O2 |
| Smiles: | CCNc1nc2c(C(N(C)C(N2C)=O)=O)n1CCC(C)C |
| Stereo: | ACHIRAL |
| logP: | 2.7416 |
| logD: | 2.7358 |
| logSw: | -3.0019 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.994 |
| InChI Key: | WFYFUWNCPABUGS-UHFFFAOYSA-N |