(-)-(S)-Bay K 8644

CAS Registry Number®

98625-26-4

CAS Name

(-)-(S)-Bay K 8644

Molecular Formula

C16H15F3N2O4

Molecular Mass

356.30

Cite this Page

(-)-(S)-Bay K 8644.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=98625-26-4 (retrieved 2024-11-21) (CAS RN: 98625-26-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H15F3N2O4/c1-8-12(15(22)25-3)13(14(21(23)24)9(2)20-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3/t13-/m0/s1

InChIKey

InChIKey=ZFLWDHHVRRZMEI-ZDUSSCGKSA-N

SMILES

C(OC)(=O)C=1[C@@H](C(N(=O)=O)=C(C)NC1C)C2=C(C(F)(F)F)C=CC=C2

Canonical SMILES

O=C(OC)C1=C(NC(=C(N(=O)=O)C1C=2C=CC=CC2C(F)(F)F)C)C

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-, methyl ester, (4S)-
  • 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-, methyl ester, (S)-
  • (-)-(S)-Bay K 8644
  • BAY-R 5417
  • (-)-BAY R 5417

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Deleted or Replaced CAS Registry Numbers

108099-07-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration