Brequinar
CAS Registry Number®
96187-53-0
No image available.
CAS Name
BrequinarMolecular Formula
C23H15F2NO2Molecular Mass
375.37Cite this Page
Brequinar. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=96187-53-0 (retrieved ) (CAS RN: 96187-53-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
315-317 °C
Source(s)
- (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)
Other Names and Identifiers
InChI
InChI=1S/C23H15F2NO2/c1-13-21(23(27)28)18-12-16(24)10-11-20(18)26-22(13)15-8-6-14(7-9-15)17-4-2-3-5-19(17)25/h2-12H,1H3,(H,27,28)
InChIKey
InChIKey=PHEZJEYUWHETKO-UHFFFAOYSA-N
SMILES
CC=1C(=NC2=C(C1C(O)=O)C=C(F)C=C2)C3=CC=C(C=C3)C4=C(F)C=CC=C4
Canonical SMILES
O=C(O)C=1C=2C=C(F)C=CC2N=C(C=3C=CC(=CC3)C=4C=CC=CC4F)C1C
Other Names for this Substance
- 4-Quinolinecarboxylic acid, 6-fluoro-2-(2′-fluoro[1,1′-biphenyl]-4-yl)-3-methyl-
- 6-Fluoro-2-(2′-fluoro[1,1′-biphenyl]-4-yl)-3-methyl-4-quinolinecarboxylic acid
- Brequinar
- Biphenquinate
- BPQ
