7-butyl-8-(4-fluorophenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-butyl-8-(4-fluorophenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-butyl-8-(4-fluorophenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 4281-0300 |
| Compound Name: | 7-butyl-8-(4-fluorophenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 346.36 |
| Molecular Formula: | C17 H19 F N4 O3 |
| Smiles: | CCCCn1c2C(N(C)C(N(C)c2nc1Oc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7753 |
| logD: | 3.7753 |
| logSw: | -3.8495 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.002 |
| InChI Key: | CWWHQGJKOKISPN-UHFFFAOYSA-N |