1,3,7-trimethyl-8-phenethyloxy-purine-2,6-dione

Modify Date: 2025-09-07 11:39:33

1,3,7-trimethyl-8-phenethyloxy-purine-2,6-dione Structure
1,3,7-trimethyl-8-phenethyloxy-purine-2,6-dione structure
Common Name 1,3,7-trimethyl-8-phenethyloxy-purine-2,6-dione
CAS Number 5415-84-9 Molecular Weight 314.33900
Density 1.3g/cm3 Boiling Point 510.3ºC at 760 mmHg
Molecular Formula C16H18N4O3 Melting Point N/A
MSDS N/A Flash Point 262.4ºC

 Names

Name 1,3,7-trimethyl-8-(2-phenylethoxy)purine-2,6-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3g/cm3
Boiling Point 510.3ºC at 760 mmHg
Molecular Formula C16H18N4O3
Molecular Weight 314.33900
Flash Point 262.4ºC
Exact Mass 314.13800
PSA 71.05000
LogP 0.59220
Index of Refraction 1.635
InChIKey XEJFGTMHCXBIOL-UHFFFAOYSA-N
SMILES Cn1c(=O)c2c(nc(OCCc3ccccc3)n2C)n(C)c1=O

 Bioassay

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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
Name: Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
Source: ChEMBL
Target: Klebsiella pneumoniae
External Id: CHEMBL4296186
Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay
Source: 24386
Target: N/A
External Id: Sarm1 TIR NADase inhibitors
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 Synonyms

1,3,7-trimethyl-8-phenethyloxy-3,7-dihydro-purine-2,6-dione
1,3,7-trimethyl-8-phenethyloxypurine-2,6-dione
1,3,7-Trimethyl-8-phenaethyloxy-3,7-dihydro-purin-2,6-dion
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