8-(4-tert-butylphenoxy)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(4-tert-butylphenoxy)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
8-(4-tert-butylphenoxy)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5692-0779 |
| Compound Name: | 8-(4-tert-butylphenoxy)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C18 H22 N4 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)Oc1nc2c(C(N(C)C(N2C)=O)=O)n1C |
| Stereo: | ACHIRAL |
| logP: | 4.0506 |
| logD: | 4.0506 |
| logSw: | -4.1586 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.834 |
| InChI Key: | JGDCYODEIZBFDK-UHFFFAOYSA-N |