Ivacaftor

CAS Registry Number®

873054-44-5

CAS Name

Ivacaftor

Molecular Formula

C24H28N2O3

Molecular Mass

392.49

Cite this Page

Ivacaftor.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=873054-44-5 (retrieved 2024-11-21) (CAS RN: 873054-44-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    124-128 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C24H28N2O3/c1-23(2,3)16-11-17(24(4,5)6)20(27)12-19(16)26-22(29)15-13-25-18-10-8-7-9-14(18)21(15)28/h7-13,27H,1-6H3,(H,25,28)(H,26,29)

InChIKey

InChIKey=PURKAOJPTOLRMP-UHFFFAOYSA-N

SMILES

C(C)(C)(C)C1=C(NC(=O)C=2C(=O)C=3C(NC2)=CC=CC3)C=C(O)C(C(C)(C)C)=C1

Canonical SMILES

O=C(NC1=CC(O)=C(C=C1C(C)(C)C)C(C)(C)C)C2=CNC=3C=CC=CC3C2=O

Other Names for this Substance

  • 3-Quinolinecarboxamide, N-[2,4-bis(1,1-dimethylethyl)-5-hydroxyphenyl]-1,4-dihydro-4-oxo-
  • N-[2,4-Bis(1,1-dimethylethyl)-5-hydroxyphenyl]-1,4-dihydro-4-oxo-3-quinolinecarboxamide
  • VX 770
  • Ivacaftor
  • Kalydeco

View All

Deleted or Replaced CAS Registry Numbers

1174930-71-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration