Products 1413431-07-8

CAS 1413431-07-8 appears in our catalog under these names: Ivacaftor (4-tertbutyl-d9) (Major), >95% (HPLC), Ivacaftor (4-tertbutyl-d9) (major), Ivacaftor-d9, 99.44%. Offered by: TRC, Biosynth, MedChemExpress. Available pack sizes: 1mg, 5mg, 2mg, 10mg, 10 mg, 5 mg.

Ivacaftor (4-tertbutyl-d9) (Major), >95% (HPLC)
TRC
  • size: 1mg, 5mg
  • Variants: 2
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Ivacaftor (4-tertbutyl-d9) (major)
Biosynth
  • size: 2mg, 1mg, 5mg, 10mg
  • Variants: 4
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Ivacaftor-d9, 99.44%
MedChemExpress
  • size: 10 mg, 5 mg
  • Variants: 2
from 1894.01
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Structural formula: {0} (CAS {1})

N-[2-tert-butyl-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]-5-hydroxyphenyl]-4-oxo-1H-quinoline-3-carboxamide (CAS 1413431-07-8) is a chemical compound with the molecular formula C24H28N2O3 and a molecular weight of 401.5 g/mol. IUPAC name: N-[2-tert-butyl-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]-5-hydroxyphenyl]-4-oxo-1H-quinoline-3-carboxamide. InChIKey: PURKAOJPTOLRMP-ASMGOKTBSA-N.

Identity
Molecular formulaC24H28N2O3
Molecular weight401.5 g/mol
IUPAC nameN-[2-tert-butyl-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]-5-hydroxyphenyl]-4-oxo-1H-quinoline-3-carboxamide
InChIKeyPURKAOJPTOLRMP-ASMGOKTBSA-N
SMILES[2H]C([2H])([2H])C(C1=C(C=C(C(=C1)C(C)(C)C)NC(=O)C2=CNC3=CC=CC=C3C2=O)O)(C([2H])([2H])[2H])C([2H])([2H])[2H]

Computed by PubChem (NCBI)

Synonyms: Deutivacaftor, D9-ivacaftor, Ivacaftor D9, Deutivacaftor [USAN], DEUTIVACAFTOR [INN], DEUTIVACAFTOR [WHO-DD], deutivacaftorum, Ivacaftor-D9, DEUTERATED IVACAFTOR, Ivacaftor (4-tertbutyl-d9) (Major)
Related forms of this compound
N-(2,4-ditert-butyl-5-hydroxyphenyl)-4-oxo-1H-quinoline-3-carboxamide C24H28N2O3
N-(2,4-ditert-butyl-5-hydroxyphenyl)-4-oxo-1H-quinoline-3-carboxamide C24H28N2O3
Isomers (same molecular formula)
5-[(1R)-2-[(5,6-diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one C24H28N2O3
1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol C24H28N2O3
1,1-bis[4-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]ethanol C24H28N2O3
N,N-diethyl-3-hydroxy-4-spiro[chromene-2,4'-piperidine]-4-ylbenzamide C24H28N2O3
N,N-diethyl-4-(5-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide C24H28N2O3
4-[2-(1-ethyl-5-oxo-4,4-diphenylpyrrolidin-3-yl)ethyl]morpholin-3-one C24H28N2O3
5-[(1R)-2-[[5-ethyl-6-(2,2,2-trideuterioethyl)-2,3-dihydro-1H-inden-2-yl]amino]-1-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one C24H28N2O3
(2S)-2-[[4-(2-cyanophenyl)phenyl]methyl-pentanoylamino]-3-methylbutanoic acid C24H28N2O3
N-(3,5-ditert-butyl-2-hydroxyphenyl)-4-oxo-1H-quinoline-3-carboxamide C24H28N2O3
(5-amino-2,4-ditert-butylphenyl) 4-oxo-1H-quinoline-3-carboxylate C24H28N2O3