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Oxyphenonium bromide

Oxyphenonium bromide structure

CAS No:
50-10-2
Formula:
C21H34NO3.Br
Chemical Name:
Oxyphenonium bromide
Synonyms:
Ethanaminium,2-[(2-cyclohexyl-2-hydroxy-2-phenylacetyl)oxy]-N,N-diethyl-N-methyl-,bromide (1:1);Diethyl(2-hydroxyethyl)methylammonium bromide α-phenylcyclohexaneglycolate;Ammonium,diethyl(2-hydroxyethyl)methyl-,bromide,α-phenylcyclohexaneglycolate;Ethanaminium,2-[(cyclohexylhydroxyphenylacetyl)oxy]-N,N-diethyl-N-methyl-,bromide;Cyclohexaneglycolic acid,α-phenyl-,ester with diethyl(2-hydroxyethyl)methylammonium bromide;Oxyphenonium bromide;Spasmophen;Antrenyl;Antrenil;Ba-5473;C 5473;Oxifenon;Oxyfenon;Oxyphenon;dl-Oxyphenonium bromide;(±)-Oxyphenonium bromide;Antrenyl Duplex;Spasmodin;[2-[(2-Cyclohexyl-2-hydroxy-2-phenylacetyl)oxy]ethyl]diethylmethylazanium bromide;108940-72-3
Categories:
Organic Chemistry > Amides

Description

A quaternary ammonium anticholinergic agent with peripheral side effects similar to those of ATROPINE. It is used as an adjunct in the treatment of gastric and duodenal ulcer, and to relieve visceral spasms. The drug has also been used in the form of eye drops for mydriatic effect.

Oxyphenonium bromide Basic Attributes

Molecular Weight：

428.4

Exact Mass：

427.17200

EC Number：

200-010-7

NSC Number：

759248

DSSTox ID：

DTXSID4045632

Characteristics

PSA：

46.5

XLogP3：

0.48810

Density：

1.2584 (rough estimate)

Melting Point：

191.5 °C

Refractive Index：

1.6200 (estimate)

Toxicity：

LD50 orl-rat: 995 mg/kg JPETAB 108,292,53

Collision Cross Section：

187 Å² [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

20/21/22

safety instructions：

RTECS Number：

BP7625000

Marks：

Precautionary statement(s)：

P280

Hazard Statements：

H302-H312-H332

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, 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：

Drugs that bind to but do not activate MUSCARINIC RECEPTORS, thereby blocking the actions of endogenous ACETYLCHOLINE or exogenous agonists. Muscarinic antagonists have widespread effects including actions on the iris and ciliary muscle of the eye, the heart and blood vessels, secretions of the respiratory tract, GI system, and salivary glands, GI motility, urinary bladder tone, and the central nervous system. (See all compounds classified as Muscarinic Antagonists.)|Agents that inhibit the actions of the parasympathetic nervous system. The major group of drugs used therapeutically for this purpose is the MUSCARINIC ANTAGONISTS. (See all compounds classified as Parasympatholytics.)|Agents that dilate the pupil. They may be either sympathomimetics or parasympatholytics. (See all compounds classified as Mydriatics.)

MeSH Entry Terms：

2-((Cyclohexylhydroxyphenylacetyl)oxy)-N,N-diethyl-N-methylethanaminium

Oxyphenonium bromide Use and Manufacturing

Uses

anticholinergic, anticonvulsant

Use Classification：

Human Drugs -> FDA Approved Drug Products with Therapeutic Equivalence Evaluations (Orange Book) -> Active Ingredients

Computed Properties

Molecular Weight:428.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:427.17221
Monoisotopic Mass:427.17221
Topological Polar Surface Area:46.5
Heavy Atom Count:26
Complexity:409
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

Drug Function and Efficacy

No specific pharmacological effects mentioned

This ingredient has been used in drugs with the following functions (note: it does not mean that the ingredient itself has the following health functions)

Related Drugs

Oxphenanium bromide
Manufacturer	China Resources Double-Crane Pharmaceutical Co., Ltd.

Oxphenanium bromide tablets
Ingredients	Oxphenanium bromide
Specifications	5mg
Manufacturer	China Resources Double-Crane Pharmaceutical Co., Ltd.

Registered Holders

China Resources Double-Crane Pharmaceutical Co., Ltd.

China
Active

Recommended Suppliers of Oxyphenonium bromide

Shaanxi Dideu Medichem Co. Ltd Contact Supplier

CN
5 YRS

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Oxyphenonium bromide

CAS No.: 50-10-2

Grade: Industrial Grade

Content: 99%

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