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Bisoprolol fumarate

Bisoprolol fumarate structure

CAS No:
104344-23-2
Formula:
C18H31NO4.¹/2C4H4O4
Chemical Name:
Bisoprolol fumarate
Synonyms:
2-Propanol,1-[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]-3-[(1-methylethyl)amino]-,(2E)-2-butenedioate (2:1);2-Propanol,1-[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]-3-[(1-methylethyl)amino]-,(±)-,(E)-2-butenedioate (2:1) (salt);2-Propanol,1-[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]-3-[(1-methylethyl)amino]-,(E)-2-butenedioate (2:1) (salt);2-Propanol,1-[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]-3-[(1-methylethyl)amino]-,(2E)-2-butenedioate (2:1) (salt);Bisoprolol fumarate;EMD 33512;Concor;Bisoprolol hemifumarate;Zebeta;Eurtadal;Monocor;Detensiel;Emvoncor;Soprol;Isoten;Emcor;Maintate;1-(4-((2-Isopropoxyethoxy)methyl)phenoxy)-3-(isopropylamino)propan-2-ol hemifumarate;112945-47-8
Categories:
Organic Chemistry > Amides

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Description

White SolidBisoprolol fumarate is a β1-selective adrenergic blocker useful in the treatment of essential hypertension.

A cardioselective beta-1 adrenergic blocker. It is effective in the management of HYPERTENSION and ANGINA PECTORIS.

Bisoprolol fumarate Basic Attributes

Molecular Weight：

441.52

Exact Mass：

325.225308

EC Number：

1312995-182-4

DSSTox ID：

DTXSID1045794

HScode：

2922190900

Characteristics

PSA：

134.55000

XLogP3：

2.46860

Appearance：

white solid

Density：

1.033 g/cm3

Melting Point：

100 °C

Boiling Point：

445ºC at 760 mmHg

Flash Point：

222.9ºC

Water Solubility：

DMSO: >20 mg/mL

Storage Conditions：

Store at RT

Vapor Pressure：

9.54X10-9 mm Hg at 25 °C (est)

Toxicity：

Oral-Rat LD50: 940 mg/kg; Oral-Mouse LD50：678 mg/kg

Flammability characteristics：

Combustible; Fire breaks down toxic nitrogen oxide fumes

PKA：

9.5None

Safety Information

Hazard category：

IRRITANT

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

RTECS Number：

UB8390000

Marks：

Xn,Xi

Storage features：

Warehouse low temperature, ventilated, dry

Stability/Shelf Life：

Stable under recommended storage conditions.

Precautionary statement(s)：

P301 + P312 + P330

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P260, P263, P264, P270, P273, P281, P301+P312, P308+P313, P330, P405, and P501|Aggregated GHS information provided by 139 companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Toxicity

Toxicity class：

moderately toxic

Drug Information

Drug Indication：

Treatment of heart failure, Treatment of hypertension|Treatment of hypertension, Treatment of ischaemic coronary artery disorders|Chronic stable angina pectoris, Treatment of hypertension|Angina pectoris, Essential hypertension, Secondary hypertension|Treatment of ischaemic coronary artery disorders|Treatment of hypertension|Treatment of coronary artery disease, Treatment of heart failure, Treatment of hypertension

MeSH：

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.)|Drugs that bind to and block the activation of ADRENERGIC BETA-1 RECEPTORS. (See all compounds classified as Adrenergic beta-1 Receptor Antagonists.)|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.)

MeSH Entry Terms：

Bisoprolol

Bisoprolol fumarate Use and Manufacturing

Uses

A selective α-adrenergic blocker.Used as an antihypertensive.

Use Classification：

Human Drugs -> EU pediatric investigation plans|Human Drugs -> FDA Approved Drug Products with Therapeutic Equivalence Evaluations (Orange Book) -> Active Ingredients

Computed Properties

Molecular Weight:767.0
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:26
Exact Mass:766.46157554
Monoisotopic Mass:766.46157554
Topological Polar Surface Area:195
Heavy Atom Count:54
Complexity:397
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

Drug Function and Efficacy

No specific description of pharmacological action is provided

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)

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Registered Holders

MICRO LABS LTD

United States
Active
MSN PHARMACHEM PRIVATE LTD

United States
Active
APITORIA PHARMA PRIVATE LTD

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