ChemicalBook--->CAS DataBase List--->577953-88-9

577953-88-9

577953-88-9 Structure

577953-88-9 Structure
IdentificationBack Directory
[Name]

Montelukast Dicyclohexylamine Salt
[CAS]

577953-88-9
[Synonyms]

Montelukast raceMate
Montelukast racemate CRS
Montelast dicyclohexylamine
Montelukast Racemate (1446848)
Montelukast racemate (Y0001433)
Montelukast Dicyclohexylamine RS
Montelukast Dicyclohexylamine Salt
Montelukast dicyclohexylamine Impurity
Montelukast Dicyclohexylamine (1446815)
Montelukast Dicyclohexylamine/ Montelukast DCHA
Montelukast dicyclohexylamine salt 577953-88-9
1-(((1(R)-(3-(2-(7-chloro-2-quinolinil)ethenyl)phenyl)-3-(2-(1-hydroxy-1-methylethyl)phenyl)propyl)thio)methyl)cyclopropaneaceticaciddicyclohexylaminesal
1-(((1(R)-(3-(2-(7-chloro-2-quinolinil)ethenyl)phenyl)-3-(2-(1-hydroxy-1-methylethyl)phenyl)propyl)thio)methyl)cyclopropane acetic acid dicyclohexylamine salt
1-[1-[[[(1R)-1-[3-[(1E)-2-(7-Chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]cyclopropaneacetic N-Cyclohexylcyclohexanamine
Montelukast sodium impurity 8/Montelukast Dicyclohexylamine/1-[1-[[[(1R)-1-[3-[(1E)-2-(7-Chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]cyclopropaneacetic N-Cyclohexylcyclohexanamine
[EINECS(EC#)]

611-575-8
[Molecular Formula]

C47H59ClN2O3S
[MDL Number]

MFCD23160308
[MOL File]

577953-88-9.mol
[Molecular Weight]

767.51
Chemical PropertiesBack Directory
[Melting point ]

65-67°C
[density ]

1.2g/cm3 at 20℃
[storage temp. ]

-20°C Freezer
[solubility ]

Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
[form ]

neat
[color ]

White to Pale Beige
[Major Application]

pharmaceutical
pharmaceutical small molecule
[InChIKey]

ZLOLVGQQYDQBMP-UJCKLGLENA-N
[SMILES]

N(C1CCCCC1)C1CCCCC1.C(C1(CC1)CC(=O)O)S[C@@H](C1C=CC=C(/C=C/C2C=CC3=CC=C(Cl)C=C3N=2)C=1)CCC1C=CC=CC=1C(O)(C)C |&1:22,r|
[LogP]

0.24-4.9 at 20℃
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319
[Precautionary statements ]

P305+P351+P338
[WGK Germany ]

WGK 3
[REACH Registrations]

Active
[HS Code ]

2933497050
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Aquatic Acute 1
Aquatic Chronic 1
Hazard InformationBack Directory
[Chemical Properties]

Pale Beige Solid
[Uses]

Montelukast Dicyclohexylamine Salt is a selective leukotriene D4-receptor antagonist. Used as an antiasthmatic.
[in vivo]

Montelukast (3 mg/kg; oral gavage) protects against APAP-induced hepatotoxicity in mice[1].
Montelukast (1 mg/kg; miniosmotic pump administration) reduces the airway remodeling changes observed in OVA-treated mice and blocks the actions of cysteinyl leukotrienes (LT) C4, D4, and E4 mediated by the CysLT1 receptor[2].
Montelukast (1 mg/kg; miniosmotic pump administration) reduces the elevated levels of IL-4 and IL-13 found in the BAL fluid of OVA-treated mice[2].

Animal Model:C57BL/6J mice (8-week-old; 22-25 g) are induced acute hepatic injury[1]
Dosage:3 mg/kg
Administration:Oral gavage 1 h after saline or APAP administration
Result:Decreased serum levels of alanine transaminase (ALT) and aspartate aminotransferase (AST), and alleviated liver damage.
[IC 50]

CysLT1
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