7-ethyl-3-(4-fluorophenyl)-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-ethyl-3-(4-fluorophenyl)-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
7-ethyl-3-(4-fluorophenyl)-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | V012-6936 |
Compound Name: | 7-ethyl-3-(4-fluorophenyl)-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 332.33 |
Molecular Formula: | C16 H17 F N4 O3 |
Smiles: | CCn1cnc2c1C(N(CCOC)C(N2c1ccc(cc1)F)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.0739 |
logD: | 1.0739 |
logSw: | -1.9051 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 50.863 |
InChI Key: | BIFQBKRPLJREQO-UHFFFAOYSA-N |