3-(2,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
3-(2,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | V024-1318 |
Compound Name: | 3-(2,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 412.37 |
Molecular Formula: | C21 H15 F3 N4 O2 |
Salt: | not_available |
Smiles: | C=CCN1C(c2c(ncn2Cc2cccc(c2)F)N(C1=O)c1ccc(cc1F)F)=O |
Stereo: | ACHIRAL |
logP: | 3.0109 |
logD: | 3.0109 |
logSw: | -3.2406 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 42.223 |
InChI Key: | JWJZQJQDHDVZMR-UHFFFAOYSA-N |