| SpectraBase Spectrum ID |
1VUR3oPICLj |
| Name |
1,3-Dimethyl-7-[4-(4-pyrimidin-2-yl-piperazin-1-yl)-butyl]-3,7-dihydropurine-2,6-dione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.217872107 u |
| Formula |
C19H26N8O2 |
| InChI |
InChI=1S/C19H26N8O2/c1-23-16-15(17(28)24(2)19(23)29)27(14-22-16)9-4-3-8-25-10-12-26(13-11-25)18-20-6-5-7-21-18/h5-7,14H,3-4,8-13H2,1-2H3 |
| InChIKey |
JQVWJEUZBRQWDN-UHFFFAOYSA-N |
| Molecular Weight |
398.471 g/mol |
| SMILES |
C12=C(C(N(C(N2C)=O)C)=O)N(CCCCN2CCN(C3=NC=CC=N3)CC2)C=N1 |
![1,3-Dimethyl-7-[4-(4-pyrimidin-2-yl-piperazin-1-yl)-butyl]-3,7-dihydropurine-2,6-dione](/api/spectrum/1VUR3oPICLj/structure.png?h=300&w=458 "1,3-Dimethyl-7-[4-(4-pyrimidin-2-yl-piperazin-1-yl)-butyl]-3,7-dihydropurine-2,6-dione")
