CAS Number873054-44-5
SynonymsIvacaftor; Kalydeco; N-(2,4-ditert-butyl-5-hydroxyphenyl)-4-oxo-1H-quinoline-3-carboxamide; MFCD17171361; VX770; UNII-1Y740ILL1Z; N-[2,4-bis(1,1-dimethylethyl)-5-hydroxyphenyl]-1,4-dihydro-4-oxoquinoline-3-carboxaraide; N-[2,4-bis(1,1-dimethylethyl)-5-hydroxyphenyl]-1,4-dihydro-4-oxoquinoline-3-carboxamide; N-[5-Hydroxy-2,4-bis(2-methyl-2-propanyl)phenyl]-4-oxo-1,4-dihydro-3-quinolinecarboxamide; N-(2,4-di-tert-butyl-5-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide; N-[2,4-Bis(tert-butyl)-5-hydroxyphenyl]-1,4-dihydro-4-oxo-3-quinolinecarboxamide; VX-770
Molecular FormulaC24H28O3N2
Molecular Weight392.5
Density1.2±0.1 g/cm3
Boiling Point550.5±50.0 °C at 760 mmHg
Appearancewhite powder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 873054-44-5 |
| Catalog No. | 2A-9092741 |
| Chinese Name | 依伐卡托 |
| Synonyms | Ivacaftor; Kalydeco; N-(2,4-ditert-butyl-5-hydroxyphenyl)-4-oxo-1H-quinoline-3-carboxamide; MFCD17171361; VX770; UNII-1Y740ILL1Z; N-[2,4-bis(1,1-dimethylethyl)-5-hydroxyphenyl]-1,4-dihydro-4-oxoquinoline-3-carboxaraide; N-[2,4-bis(1,1-dimethylethyl)-5-hydroxyphenyl]-1,4-dihydro-4-oxoquinoline-3-carboxamide; N-[5-Hydroxy-2,4-bis(2-methyl-2-propanyl)phenyl]-4-oxo-1,4-dihydro-3-quinolinecarboxamide; N-(2,4-di-tert-butyl-5-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide; N-[2,4-Bis(tert-butyl)-5-hydroxyphenyl]-1,4-dihydro-4-oxo-3-quinolinecarboxamide; VX-770 |
| Molecular Formula | C24H28O3N2 |
| Molecular Weight | 392.5 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 550.5±50.0 °C at 760 mmHg |
| Appearance | white powder |
| Storage Condition | 2~8℃ |
| Application | Ivacaftor is a potent orally available CFTR potentiator targeting G551D-CFTR and F508del-CFTR with EC50s of 100 nM and 25 nM, respectively. |
| HTC | 29333990 |
| PubChem ID | 24902571 |
| MDL Number | MFCD17171361 |
| SMILES | CC(C)(C)c1cc(C(C)(C)C)c(NC(=O)c2c[nH]c3ccccc3c2=O)cc1O |
| 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) |
| InChI Key | PURKAOJPTOLRMP-UHFFFAOYSA-N |
| MSDS | msds/92741_1_873054_44_5.pdf |
| Transport Info | Product name: Ivacaftor (VX-770) |
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