| SpectraBase Spectrum ID |
96Sh7Wm1aEY |
| Name |
7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-[4-(1-oxobutyl)phenoxy]purine-2,6-dione |
| Alternate Name(s) |
8-(4-butanoylphenoxy)-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-purine-2,6-dione
8-(4-butyrylphenoxy)-7-(2-fluorobenzyl)-1,3-dimethyl-xanthine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H23FN4O4 |
| InChI |
InChI=1S/C24H23FN4O4/c1-4-7-19(30)15-10-12-17(13-11-15)33-23-26-21-20(22(31)28(3)24(32)27(21)2)29(23)14-16-8-5-6-9-18(16)25/h5-6,8-13H,4,7,14H2,1-3H3 |
| InChIKey |
MGPOOBSCEGNKRC-UHFFFAOYSA-N |
| Molecular Weight |
450.470 g/mol |
| SMILES |
c12c([n](Cc3c(F)cccc3)c(n1)Oc1ccc(C(=O)CCC)cc1)C(N(C)C(N2C)=O)=O |
| SPLASH |
splash10-0a4i-4940300000-fe496d073042ba1572de |
| Wiley ID |
1444664 |
![7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-[4-(1-oxobutyl)phenoxy]purine-2,6-dione](/api/spectrum/96Sh7Wm1aEY/structure.png?h=300&w=458 "7-[(2-fluorophenyl)methyl]-1,3-dimethyl-8-[4-(1-oxobutyl)phenoxy]purine-2,6-dione")
