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Pentolinium bitartrate

Pentolinium bitartrate structure

CAS No:
52-62-0
Formula:
C15H32N2.2C4H5O6
Chemical Name:
Pentolinium bitartrate
Synonyms:
Pyrrolidinium,1,1′-(1,5-pentanediyl)bis[1-methyl-,(2R,3R)-2,3-dihydroxybutanedioate (1:2);Pyrrolidinium,1,1′-pentamethylenebis[1-methyl-,tartrate (1:2);1,1′-Pentamethylenebis[1-methylpyrrolidinium hydrogen tartrate];Pyrrolidinium,1,1′-(1,5-pentanediyl)bis[1-methyl-,salt with [R-(R*,R*)]-2,3-dihydroxybutanedioic acid (1:2);Pyrrolidinium,1,1′-(1,5-pentanediyl)bis[1-methyl-,salt with (2R,3R)-2,3-dihydroxybutanedioic acid (1:2);Tartaric acid,ion(1-),1,1′-pentamethylenebis[1-methylpyrrolidinium] (2:1);Butanedioic acid,2,3-dihydroxy-[R-(R*,R*)]-,ion(1-),1,1′-(1,5-pentanediyl)bis[1-methylpyrrolidinium] (2:1);Butanedioic acid,2,3-dihydroxy- (2R,3R)-,ion(1-),1,1′-(1,5-pentanediyl)bis[1-methylpyrrolidinium] (2:1);Ansolysen;Ansolysen bitartrate;Ansolysen tartrate;1,1′-Pentamethylenebis(1-methylpyrrolidinium tartrate);Pentapyrrolidium bitartrate;Pentilium;Pentolinium bitartrate;Pentolinium tartrate;Recuryl;Tensilest;Pendine;Pentolonium tartrate;Pentapyrrolidinium bitartrate;M and B 2050A;56614-93-8
Categories:
Active Pharmaceutical Ingredients > Circulatory System Drugs

Description

white to cream crystalline powder

Pentolinium tartrate is the bitartrate salt of pentolinium. It has a role as an antihypertensive agent. It contains a pentolinium ion.|A nicotinic antagonist that has been used as a ganglionic blocking agent in hypertension.

Pentolinium bitartrate Basic Attributes

Molecular Weight：

538.59

Exact Mass：

538.27400

EC Number：

200-146-7

UNII：

953357GACY

DSSTox ID：

DTXSID5045542

HScode：

2933990090

Characteristics

PSA：

235.78000

XLogP3：

-4.35950

Density：

1.3233 (rough estimate)

Melting Point：

203 °C (decomp)

Boiling Point：

614.82°C (rough estimate)

Refractive Index：

1.6300 (estimate)

Storage Conditions：

2-8°C

Toxicity：

LD50 orl-rat: 890 mg/kg PSEBAA 120,511,65

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

3249

hazard class code：

36/37/38-22

safety instructions：

37/39-26-36

RTECS Number：

UY4900000

Marks：

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH：

Agents having as their major action the interruption of neural transmission at nicotinic receptors on postganglionic autonomic neurons. Because their actions are so broad, including blocking of sympathetic and parasympathetic systems, their therapeutic use has been largely supplanted by more specific drugs. They may still be used in the control of blood pressure in patients with acute dissecting aortic aneurysm and for the induction of hypotension in surgery. (See all compounds classified as Ganglionic Blockers.)|Drugs that bind to nicotinic cholinergic receptors (RECEPTORS, NICOTINIC) and block the actions of acetylcholine or cholinergic agonists. Nicotinic antagonists block synaptic transmission at autonomic ganglia, the skeletal neuromuscular junction, and at central nervous system nicotinic synapses. (See all compounds classified as Nicotinic Antagonists.)|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.)

MeSH Entry Terms：

Pentolinium

Pentolinium bitartrate Use and Manufacturing

Uses

Antihypertensor;Glanglionic blocking agent

Use Classification：

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

Computed Properties

Molecular Weight:538.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:10
Exact Mass:538.27377478
Monoisotopic Mass:538.27377478
Topological Polar Surface Area:236
Heavy Atom Count:37
Complexity:347
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes