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3,7-Dimethyl-1-propargylxanthine

3,7-Dimethyl-1-propargylxanthine structure

CAS No:
14114-46-6
Formula:
C10H10N4O2
Chemical Name:
3,7-Dimethyl-1-propargylxanthine
Synonyms:
1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-1-(2-propyn-1-yl)-;Theobromine,1-(2-propynyl)-;1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-1-(2-propynyl)-;3,7-Dihydro-3,7-dimethyl-1-(2-propyn-1-yl)-1H-purine-2,6-dione;3,7-Dimethyl-1-propargylxanthine;DMPX;NSC 242985;1-Propargyl 3,7-Dimethylxanthine;3,7-Dimethyl-1-(prop-2-yn-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione;3,7-Dimethyl-1-(prop-2-yn-1-yl)-1H-purine-2,6(3H,7H)-dione;3,7-Dihydro-3,7-dimethyl-1-(2-propynyl)-1H-purine-2,6-dione;3,7-Dimethyl-1-prop-2-ynylpurine-2,6-dione
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

White Solid

3,7-Dimethyl-1-propargylxanthine Basic Attributes

Molecular Weight：

218.21

Exact Mass：

218.21

UNII：

5YFR5SPS6T

NSC Number：

242985

DSSTox ID：

DTXSID30161577

HScode：

2933990090

Characteristics

PSA：

58.4

XLogP3：

Appearance：

white solid

Density：

1.31g/cm3

Melting Point：

207 °C

Boiling Point：

443.9ºC at 760mmHg

Flash Point：

222.3ºC

Refractive Index：

1.638

Water Solubility：

DMSO: ≥15 mg/mL

Storage Conditions：

-20°C Freezer

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

22-26-36

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH：

Compounds that selectively bind to and block the activation of ADENOSINE A2 RECEPTORS. (See all compounds classified as Adenosine A2 Receptor Antagonists.)

MeSH Entry Terms：

3,7-dimethyl-1-propargylxanthine

3,7-Dimethyl-1-propargylxanthine Use and Manufacturing

A selective A2 adenosine receptor antagonist.Pharmacology:Ki vs [3H]NECA at A2 receptors in rat striatal membranes: 11± 3 uM; Ki vs [3H]CHA at A1 receptors in rat cerebral cortical membranes: 45 ± 4 uM.

Computed Properties

Molecular Weight:218.21
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:218.08037557
Monoisotopic Mass:218.08037557
Topological Polar Surface Area:58.4
Heavy Atom Count:16
Complexity:386
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 3,7-Dimethyl-1-propargylxanthine

Guangzhou Yaoguang Technology Co., Ltd. Contact Supplier

CN
5 YRS

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Manufactory Supplier of Custom Synthetic Chemicals,Biological Stains,Pharmaceutical Intermediates,Cosmetic Grade Chemicals,Enzyme,Nucleosides,Indicators,Speciality Chemicals,Biological Chemicals,Enzyme Substrates

14114-46-6

CAS No.: 14114-46-6

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Jinshu Peptide Co.,Ltd Contact Supplier

CN
3 YRS

Business licensed

Trader Supplier of peptone

China Most Professional Factory Supply High Qulity 3,7-dimethyl-1-propargylxanthine

CAS No.: 14114-46-6

Grade: Pharmaceutical Grade

Content: 99%

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Guide of 3,7-Dimethyl-1-propargylxanthine

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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3,7-Dimethyl-1-propargylxanthine

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