1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro

Modify Date: 2025-08-25 19:47:06

1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro Structure
1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro structure
Common Name 1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro
CAS Number 2850-36-4 Molecular Weight 264.32300
Density 1.179g/cm3 Boiling Point 474.7ºC at 760mmHg
Molecular Formula C13H20N4O2 Melting Point N/A
MSDS N/A Flash Point 240.9ºC

 Names

Name 1,3-dibutyl-7H-purine-2,6-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.179g/cm3
Boiling Point 474.7ºC at 760mmHg
Molecular Formula C13H20N4O2
Molecular Weight 264.32300
Flash Point 240.9ºC
Exact Mass 264.15900
PSA 72.68000
LogP 1.48650
Vapour Pressure 3.54E-09mmHg at 25°C
Index of Refraction 1.545
InChIKey HDAPVDGMACVEKL-UHFFFAOYSA-N
SMILES CCCCn1c(=O)c2[nH]cnc2n(CCCC)c1=O

 Safety Information

Risk Phrases 20/21/22
Safety Phrases 22-36/37/39
HS Code 2933990090

 Synthetic Route

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1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro Structure

1H-Purine-2,6-d...

CAS#:2850-36-4

Literature: Speer; Raymond Journal of the American Chemical Society, 1953 , vol. 75, p. 114

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1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro Structure

1H-Purine-2,6-d...

CAS#:2850-36-4

Literature: Kim, Hea Ok; Ji, Xiao-duo; Melman, Neli; Olah, Mark E.; Stiles, Gary L.; Jacobson, Kenneth A. Journal of Medicinal Chemistry, 1994 , vol. 37, # 20 p. 3373 - 3382

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1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro Structure

1H-Purine-2,6-d...

CAS#:2850-36-4

Literature: Kim, Hea Ok; Ji, Xiao-duo; Melman, Neli; Olah, Mark E.; Stiles, Gary L.; Jacobson, Kenneth A. Journal of Medicinal Chemistry, 1994 , vol. 37, # 20 p. 3373 - 3382

~%

1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro Structure

1H-Purine-2,6-d...

CAS#:2850-36-4

Literature: Kim, Hea Ok; Ji, Xiao-duo; Melman, Neli; Olah, Mark E.; Stiles, Gary L.; Jacobson, Kenneth A. Journal of Medicinal Chemistry, 1994 , vol. 37, # 20 p. 3373 - 3382

~%

1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro Structure

1H-Purine-2,6-d...

CAS#:2850-36-4

Literature: Searle and Co. Patent: US2602795 , 1950 ;

~%

1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro Structure

1H-Purine-2,6-d...

CAS#:2850-36-4

Literature: Speer; Raymond Journal of the American Chemical Society, 1953 , vol. 75, p. 114

~%

1H-Purine-2,6-dione,1,3-dibutyl-3,9-dihydro Structure

1H-Purine-2,6-d...

CAS#:2850-36-4

Literature: Kim, Hea Ok; Ji, Xiao-duo; Melman, Neli; Olah, Mark E.; Stiles, Gary L.; Jacobson, Kenneth A. Journal of Medicinal Chemistry, 1994 , vol. 37, # 20 p. 3373 - 3382

 Customs

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%

 Bioassay

View more

Name: Displacement of [3H]PIA from adenosine A1 receptors of rat brain membrane
Source: ChEMBL
Target: Adenosine receptor A1
External Id: CHEMBL639750
Name: Displacement of [3H]-CGS- 21680 from adenosine A2a receptors of rat striatal membrane
Source: ChEMBL
Target: Adenosine receptor A2a
External Id: CHEMBL640429
Name: Ratio of selectivity for A3 and A2a receptors at rat brain
Source: ChEMBL
Target: Adenosine receptor A2a and A3
External Id: CHEMBL844663
Name: Ratio of selectivity for A3 and A1 receptors at rat brain
Source: ChEMBL
Target: Adenosine receptors; A1 & A3
External Id: CHEMBL844662
Name: Displacement of [125I]AB-MECA from membranes of CHO cells stably transfected with the...
Source: ChEMBL
Target: Adenosine receptor A3
External Id: CHEMBL642022
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 Synonyms

1,3-Di-n-butylxanthine
1,3-dibutyl-3,7-dihydropurine-2,6-dione
1,3-Dibutyl-3,7-dihydro-1H-purine-2,6-dione
MFCD00798591
1,3-Dibutylxanthine
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