N-[(2′-Cyano[1,1′-biphenyl]-4-yl)methyl]-L-valine methyl ester hydrochloride (1:1)

CAS Registry Number®

482577-59-3

CAS Name

N-[(2′-Cyano[1,1′-biphenyl]-4-yl)methyl]-L-valine methyl ester hydrochloride (1:1)

Molecular Formula

C20H22N2O2.ClH

Cite this Page

N-[(2′-Cyano[1,1′-biphenyl]-4-yl)methyl]-L-valine methyl ester hydrochloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=482577-59-3 (retrieved 2024-11-22) (CAS RN: 482577-59-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    186 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H22N2O2.ClH/c1-14(2)19(20(23)24-3)22-13-15-8-10-16(11-9-15)18-7-5-4-6-17(18)12-21;/h4-11,14,19,22H,13H2,1-3H3;1H/t19-;/m0./s1

InChIKey

InChIKey=AZQXUWUZQLZNIM-FYZYNONXSA-N

SMILES

C(#N)C1=C(C=CC=C1)C2=CC=C(CN[C@H](C(OC)=O)C(C)C)C=C2.Cl

Canonical SMILES

Cl.N#CC=1C=CC=CC1C=2C=CC(=CC2)CNC(C(=O)OC)C(C)C

Other Names for this Substance

  • L-Valine, N-[(2′-cyano[1,1′-biphenyl]-4-yl)methyl]-, methyl ester, hydrochloride (1:1)
  • L-Valine, N-[(2′-cyano[1,1′-biphenyl]-4-yl)methyl]-, methyl ester, monohydrochloride
  • N-[(2′-Cyano[1,1′-biphenyl]-4-yl)methyl]-L-valine methyl ester hydrochloride (1:1)
  • (S)-Methyl 2-(((2′-cyano-[1,1′-biphenyl]-4-yl)methyl)amino)-3-methylbutanoate hydrochloride
  • N-[2′-Cyanobiphenyl-4-yl-methyl](L)-valine methyl ester hydrochloride

CAS INSIGHTSTM
Targeted protein degrader structure, illustration