Arformoterol tartrate - 10mM in DMSO , CAS No.200815-49-2

CAS: 200815-49-2 Cat. No.: A422442 Molecular Weight: 494.49 EC Number: 696-617-3 PubChem CID: 9827062

GRADE & PURITY 10mM in DMSO

Synonyms

Arformoterol tartrate|200815-49-2|Brovana|(R,R)-Arformoterol tartrate|Arformoterol Tartrate [USAN]|UNII-5P8VJ2I235|5P8VJ2I235|DTXSID80173903|Formamide, N-[2-hydroxy-5-[(1R)-1-hydroxy-2-[[(1R)-2-(4-methoxyphenyl)-1-methylethyl]amino]ethyl]phenyl]-, (2R,3R)

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Overview

Product Description：

Arformoterol Tartrate is the tartrate salt of arformoterol, a long-acting beta-2 adrenergic agonist with bronchodilator activity.

Specifications

Synonyms

Arformoterol tartrate | 200815-49-2 | Brovana | (R, R)-Arformoterol tartrate | Arformoterol Tartrate [USAN] | UNII-5P8VJ2I235 | 5P8VJ2I235 | DTXSID80173903 | Formamide, N-[2-hydroxy-5-[(1R)-1-hydroxy-2-[[(1R)-2-(4-methoxyphenyl)-1-methylethyl]amino]ethyl]phenyl]-, (2R, 3R)

Specifications & Purity

10mM in DMSO

Biochemical and Physiological Mechanisms

Long-acting β2adrenergic agonist (LABA). Bronchodilator.

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

This product requires cold chain shipping. Ground and other economy services are not available.

Names and Identifiers

• Canonical Smiles: CC(CC1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)NC=O)O.C(C(C(=O)O)O)(C(=O)O)O
• IUPAC Name: (2R,3R)-2,3-dihydroxybutanedioic acid;N-[2-hydroxy-5-[(1R)-1-hydroxy-2-[[(2R)-1-(4-methoxyphenyl)propan-2-yl]amino]ethyl]phenyl]formamide
• InChIKey: FCSXYHUNDAXDRH-OKMNHOJOSA-N
• INCHI: 1S/C19H24N2O4.C4H6O6/c1-13(9-14-3-6-16(25-2)7-4-14)20-11-19(24)15-5-8-18(23)17(10-15)21-12-22;5-1(3(7)8)2(6)4(9)10/h3-8,10,12-13,19-20,23-24H,9,11H2,1-2H3,(H,21,22);1-2,5-6H,(H,7,8)(H,9,10)/t13-,19+;1-,2-/m11/s1
• Isomeric SMILES: C[C@H](CC1=CC=C(C=C1)OC)NC[C@@H](C2=CC(=C(C=C2)O)NC=O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
• PubChem CID: 9827062
• Molecular Weight: 494.49

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Phenethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Phenethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Amphetamines and derivatives
• Alternative Parents: Anilides Phenylpropanes Anisoles Methoxybenzenes N-arylamides Phenoxy compounds Short-chain hydroxy acids and derivatives 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Sugar acids and derivatives Aralkylamines Beta hydroxy acids and derivatives Monosaccharides Alpha hydroxy acids and derivatives Fatty acids and conjugates Dicarboxylic acids and derivatives 1,2-aminoalcohols 1,2-diols Amino acids and derivatives Secondary alcohols Secondary carboxylic acid amides Carboxylic acids Dialkylamines Organic oxides Aromatic alcohols Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Amphetamine or derivatives - Phenylpropane - Anilide - Phenoxy compound - Anisole - Phenol ether - N-arylamide - Methoxybenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Beta-hydroxy acid - Phenol - Short-chain hydroxy acid - Sugar acid - Aralkylamine - Fatty acid - Alpha-hydroxy acid - Dicarboxylic acid or derivatives - Hydroxy acid - Monosaccharide - Amino acid or derivatives - Secondary alcohol - Secondary carboxylic acid amide - 1,2-diol - Carboxamide group - 1,2-aminoalcohol - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Ether - Secondary amine - Amine - Carbonyl group - Alcohol - Aromatic alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as amphetamines and derivatives. These are organic compounds containing or derived from 1-phenylpropan-2-amine.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Molecular Weight: 494.500 g/mol
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 11
• Exact Mass: 494.19 Da
• Monoisotopic Mass: 494.19 Da
• Topological Polar Surface Area: 206.000 Ų
• Heavy Atom Count: 35
• Formal Charge: 0
• Complexity: 521.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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