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Darifenacin hydrobromide

Darifenacin hydrobromide structure

CAS No:
133099-07-7
Formula:
C28H30N2O2.BrH
Chemical Name:
Darifenacin hydrobromide
Synonyms:
3-Pyrrolidineacetamide,1-[2-(2,3-dihydro-5-benzofuranyl)ethyl]-α,α-diphenyl-,hydrobromide (1:1),(3S)-;3-Pyrrolidineacetamide,1-[2-(2,3-dihydro-5-benzofuranyl)ethyl]-α,α-diphenyl-,monohydrobromide,(S)-;3-Pyrrolidineacetamide,1-[2-(2,3-dihydro-5-benzofuranyl)ethyl]-α,α-diphenyl-,monohydrobromide,(3S)-;UK 88525-04;Darifenacin hydrobromide;UK 88525-04 hydrobromide;Enablex;Emselex;(S)-3-(Carbamoyldiphenylmethyl)-1-[2-(2,3-dihydrobenzofuran-5-yl)ethyl]pyrrolidine hydrobromide;Darilong;2-[(3S)-1-[2-(2,3-Dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide hydrobromide
Categories:
Biochemical Engineering > Inhibitors

Description

White SolidChEBI: The hydrobromide salt of darifenacin. A selective antagonist for the M3 muscarinic acetylcholine receptor, which is primarily responsible for bladder muscle contractions, it is used in the management of urinary incontinence.Darfenacin (Enablex),(s)-2-{1-[2-(2,3-dihydrobenzofuran-5-yl)ethyl]-3-pyrrolidinyl}-2,2-diphen-ylacetamide, is an antimuscarinicagent that has selectivity for the M3 muscarinicsubtype receptor. By competitively blocking of the muscarinicreceptors results i

Darifenacin hydrobromide is the hydrobromide salt of darifenacin. A selective antagonist for the M3 muscarinic acetylcholine receptor, which is primarily responsible for bladder muscle contractions, it is used in the management of urinary incontinence. It has a role as a muscarinic antagonist. It contains a darifenacin.

Darifenacin hydrobromide Basic Attributes

Molecular Weight：

505.44606

Exact Mass：

506.15689

EC Number：

1308068-626-2

UNII：

CR02EYQ8GV

DSSTox ID：

DTXSID9046780

ATC Code：

G04BD10

HScode：

2934990002

Characteristics

PSA：

55.6

XLogP3：

5.94630

Appearance：

white to beige

Melting Point：

228-2300C

Boiling Point：

614.3°C at 760 mmHg

Flash Point：

325.3ºC

Water Solubility：

DMSO: soluble20mg/mL, clear

Storage Conditions：

-20°C Freezer

Vapor Pressure：

1.11E-16mmHg at 25°C

Specific rotation：

25D -30.3° (c = 1.0 in methylene chloride)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (95.12%): 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 41 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

Drug Indication：

Symptomatic treatment of urge incontinence and/or increased urinary frequency and urgency as may occur in adult patients with overactive bladder syndrome.

MeSH：

Drugs used in the treatment of urogenital conditions and diseases such as URINARY INCONTINENCE; PROSTATIC HYPERPLASIA; and ERECTILE DYSFUNCTION. (See all compounds classified as Urological Agents.)|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.)

MeSH Entry Terms：

(S)-1-(2-(2,3-dihydro-5-benzofuranyl)ethyl)-alpha,alpha-diphenyl-3-pyrrolidineacetamide

Darifenacin hydrobromide Use and Manufacturing

Uses

acute lymphoblastic leukemia therapeutic

Use Classification：

Human drugs -> Emselex -> EMA Drug Category|Urologicals, Drugs for urinary frequency and incontinence -> Human pharmacotherapeutic group|Human Drugs -> FDA Approved Drug Products with Therapeutic Equivalence Evaluations (Orange Book) -> Active Ingredients

Computed Properties

Molecular Weight:507.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:506.15689
Monoisotopic Mass:506.15689
Topological Polar Surface Area:55.6
Heavy Atom Count:33
Complexity:607
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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CAS No.: 133099-07-7

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