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Rolofylline

Rolofylline structure

Rolofylline 

structure
  • CAS No:

    136199-02-5

  • Formula:

    C20H28N4O2

  • Chemical Name:

    Rolofylline

  • Synonyms:

    1H-Purine-2,6-dione,8-(hexahydro-2,5-methanopentalen-3a(1H)-yl)-3,9-dihydro-1,3-dipropyl-;1H-Purine-2,6-dione,8-(hexahydro-2,5-methanopentalen-3a(1H)-yl)-3,7-dihydro-1,3-dipropyl-;2,5-Methanopentalene,1H-purine-2,6-dione deriv.;8-(Hexahydro-2,5-methanopentalen-3a(1H)-yl)-3,9-dihydro-1,3-dipropyl-1H-purine-2,6-dione;KW 3902;Rolofylline;328896-63-5

Description

Rolofylline is an oxopurine.

Rolofylline Basic Attributes

356.46200

356.46

Characteristics

72.68000

2.78400

1.262g/cm3

578ºC at 760mmHg

303.4ºC

1.605

2.33E-13mmHg at 25°C

Safety Information

|Danger|H370 (47.95%): Causes damage to organs [Danger Specific target organ toxicity, single exposure]|P260, P264, P270, P273, P307+P311, P314, P321, P405, and P501|Aggregated GHS information provided by 73 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

Heart Failure

Agents that promote the excretion of urine through their effects on kidney function. (See all compounds classified as Diuretics.)

1,3-dipropyl-8-(3-noradamantyl)xanthine

Rolofylline Use and Manufacturing

Human Drugs -> EU pediatric investigation plans

Computed Properties

Molecular Weight:356.5
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:356.22122615
Monoisotopic Mass:356.22122615
Topological Polar Surface Area:69.3
Heavy Atom Count:26
Complexity:609
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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