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33286-22-5

33286-22-5 structural image
Product Name: Diltiazem hydrochloride
Formula: C22H27ClN2O4S
Synonyms: (+)-cis-Diltiazem hydrochloride;(2S,3S)-(+)-cis-3-Acetoxy-5-(2-dimethylaminoethyl)-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one hydrochloride;CRD-401;Diltiazem, Hydrochloride - CAS 33286-22-5 - Calbiochem;L-Type Calcium Channel Blocker II
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 196.1 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral

COMPUTED DESCRIPTORS

Molecular Weight 451.0 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 450.1380062 g/mol
Monoisotopic Mass 450.1380062 g/mol
Topological Polar Surface Area 84.4 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 565
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Diltiazem hydrochloride is a hydrochloride salt resulting from the reaction of equimolar amounts of diltiazem and hydrogen chloride. A calcium-channel blocker and vasodilator, it is used in the management of angina pectoris and hypertension. It has a role as an antihypertensive agent, a vasodilator agent and a calcium channel blocker. It contains a diltiazem(1+). It is an enantiomer of an ent-diltiazem hydrochloride.

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