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Home > Encyclopedia > 4-(2,3,6,7-Tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)benzenesulfonic acid

4-(2,3,6,7-Tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)benzenesulfonic acid

4-(2,3,6,7-Tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)benzenesulfonic acid structure

4-(2,3,6,7-Tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)benzenesulfonic acid 

structure
  • CAS No:

    89073-57-4

  • Formula:

    C17H20N4O5S

  • Chemical Name:

    4-(2,3,6,7-Tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)benzenesulfonic acid

  • Synonyms:

    Benzenesulfonic acid,4-(2,3,6,7-tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)-;4-(2,3,6,7-Tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)benzenesulfonic acid;1,3-Dipropyl-8-(p-sulfophenyl)xanthine;DPSPX

4-(2,3,6,7-Tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)benzenesulfonic acid Basic Attributes

392.43

392.43

DTXSID70237528

Characteristics

132 Ų

1.3115

>300°C

1.6000 (estimate)

1.3g/L(temperature not stated)

-1.59±0.50

Safety Information

3

22-24/25

Drug Information

Compounds that bind to and block the stimulation of PURINERGIC P1 RECEPTORS. (See all compounds classified as Purinergic P1 Receptor Antagonists.)

1,3-dipropyl-8-(4-sulfophenyl)xanthine

4-(2,3,6,7-Tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)benzenesulfonic acid Use and Manufacturing

Water soluble adenosine receptor antagonist with slight selectivity for A1 receptors

Computed Properties

Molecular Weight:392.4
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:392.11544092
Monoisotopic Mass:392.11544092
Topological Polar Surface Area:132
Heavy Atom Count:27
Complexity:671
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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