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Technical details about Bethanidine, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: Bethanidine sulfate, Benzanidin, Benzanidine, Betanidole, Benzoxine, Betaling
Molecular Formula
C10H17N3O4S
Molecular Weight
275.33  g/mol
InChI Key
WDLCALUKNKNIDF-UHFFFAOYSA-N

A guanidinium antihypertensive agent that acts by blocking adrenergic transmission. The precise mode of action is not clear.
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-benzyl-2,3-dimethylguanidine;sulfuric acid
2.1.2 InChI
InChI=1S/C10H15N3.H2O4S/c1-11-10(12-2)13-8-9-6-4-3-5-7-9;1-5(2,3)4/h3-7H,8H2,1-2H3,(H2,11,12,13);(H2,1,2,3,4)
2.1.3 InChI Key
WDLCALUKNKNIDF-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CNC(=NC)NCC1=CC=CC=C1.OS(=O)(=O)O
2.2 Synonyms
2.2.1 MeSH Synonyms

1. Batel

2. Betanidine

3. Bethanidine

4. Bethanidine Sulfate

5. Bethanidine, Sulfate (2:1)

6. Sulfate, Bethanidine

2.2.2 Depositor-Supplied Synonyms

1. Bethanidine Sulfate

2. Benzanidin

3. Benzanidine

4. Betanidole

5. Benzoxine

6. Betaling

7. Betanidol

8. Bethanid

9. Esbatal

10. Eusmanid

11. Hypersin

12. Batel

13. 114-85-2 (sulfate)

14. Nsc-106563

15. Bethanidine Hemisulfate

16. 1-benzyl-2,3-dimethylguanidinium Sulfate

17. N-benzyl-n',n''-dimethylguanidine Sulfate

18. 1-benzyl-2,3-dimethylguanidine;sulfuric Acid

19. Bethanidine Sulfate (2:1)

20. Bw467c60

21. Bw 467c60

22. Nsc106563

23. 1-benzyl-2,3-dimethylguanidine Sulfate

24. Bw-467-c-60

25. 1-benzyl-2,3-dimethylguanidine Sulfate (1:1/2)

26. Schembl122035

27. Guanidine,3-dimethyl-, Sulfate (2:1)

28. Wln: 1nuym1 & M1r 2 & Wsqq

29. 467-c-60

30. Guanidine,n'-dimethyl-n''-(phenylmethyl)-, Sulfate (2:1)

2.3 Create Date
2007-12-12
3 Chemical and Physical Properties
Molecular Weight 275.33 g/mol
Molecular Formula C10H17N3O4S
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass275.09397721 g/mol
Monoisotopic Mass275.09397721 g/mol
Topological Polar Surface Area119 Ų
Heavy Atom Count18
Formal Charge0
Complexity241
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Adrenergic Agents

Drugs that act on adrenergic receptors or affect the life cycle of adrenergic transmitters. Included here are adrenergic agonists and antagonists and agents that affect the synthesis, storage, uptake, metabolism, or release of adrenergic transmitters. (See all compounds classified as Adrenergic Agents.)


Antihypertensive Agents

Drugs used in the treatment of acute or chronic vascular HYPERTENSION regardless of pharmacological mechanism. Among the antihypertensive agents are DIURETICS; (especially DIURETICS, THIAZIDE); ADRENERGIC BETA-ANTAGONISTS; ADRENERGIC ALPHA-ANTAGONISTS; ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; CALCIUM CHANNEL BLOCKERS; GANGLIONIC BLOCKERS; and VASODILATOR AGENTS. (See all compounds classified as Antihypertensive Agents.)


Sympatholytics

Drugs that inhibit the actions of the sympathetic nervous system by any mechanism. The most common of these are the ADRENERGIC ANTAGONISTS and drugs that deplete norepinephrine or reduce the release of transmitters from adrenergic postganglionic terminals (see ADRENERGIC AGENTS). Drugs that act in the central nervous system to reduce sympathetic activity (e.g., centrally acting alpha-2 adrenergic agonists, see ADRENERGIC ALPHA-AGONISTS) are included here. (See all compounds classified as Sympatholytics.)


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