1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-(1-methylethyl)
Modify Date: 2026-08-05 22:00:30
1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-(1-methylethyl) structure
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Common Name | 1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-(1-methylethyl) | ||
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| CAS Number | 2850-40-0 | Molecular Weight | 222.24400 | |
| Density | 1.284g/cm3 | Boiling Point | 447.6ºC at 760 mmHg | |
| Molecular Formula | C10H14N4O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 224.5ºC | |
| Name | 1,3-dimethyl-8-propan-2-yl-7H-purine-2,6-dione |
|---|---|
| Synonym | More Synonyms |
| Density | 1.284g/cm3 |
|---|---|
| Boiling Point | 447.6ºC at 760 mmHg |
| Molecular Formula | C10H14N4O2 |
| Molecular Weight | 222.24400 |
| Flash Point | 224.5ºC |
| Exact Mass | 222.11200 |
| PSA | 72.68000 |
| LogP | 0.08370 |
| Vapour Pressure | 3.33E-08mmHg at 25°C |
| Index of Refraction | 1.577 |
| InChIKey | NKNVOKGUNUZJFC-UHFFFAOYSA-N |
| SMILES | CC(C)c1nc2c([nH]1)c(=O)n(C)c(=O)n2C |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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| HS Code | 2933990090 |
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1H-Purine-2,6-d... CAS#:2850-40-0 |
| Literature: Speer; Raymond Journal of the American Chemical Society, 1953 , vol. 75, p. 114 |
| Precursor 2 | |
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| DownStream 0 | |
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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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
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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
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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
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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
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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
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|
Name: Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
Source: ChEMBL
Target: Klebsiella pneumoniae
External Id: CHEMBL4296186
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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.
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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
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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
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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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| 8-isopropyl-1,3-dimethyl-3,7(9)-dihydro-purine-2,6-dione |
| 1,3-dimethyl-8-isopropylxanthine |
| 8-isopropyl-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione |
| 8-isopropyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione |
| 8-Isopropyl theophylline |
| 1,3-Dimethyl-8-isopropyl-xanthin |
| Theophylline,8-isopropyl |
| 8-Isopropyl-1,3-dimethyl-3,7-dihydro-purin-2,6-dion |
| Xanthine,1,3-dimethyl-8-isopropyl |