8-(4-cyclohexylphenoxy)-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(4-cyclohexylphenoxy)-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
8-(4-cyclohexylphenoxy)-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C406-0205 |
| Compound Name: | 8-(4-cyclohexylphenoxy)-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 394.47 |
| Molecular Formula: | C22 H26 N4 O3 |
| Smiles: | CN1C(c2c(nc(n2CC=C)Oc2ccc(cc2)C2CCCCC2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.426 |
| logD: | 5.426 |
| logSw: | -5.308 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.923 |
| InChI Key: | UBUXXHBXGGQKCE-UHFFFAOYSA-N |