CAS 137863-89-9

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

Description:

N-[(2′-Cyano[1,1′-biphenyl]-4-yl)methyl]-L-valine methyl ester, with CAS number 137863-89-9, is a chemical compound characterized by its unique structural features, which include a biphenyl moiety and a cyano group. This compound is an amino acid derivative, specifically an ester of L-valine, which contributes to its potential biological activity. The presence of the cyano group enhances its reactivity and may influence its interactions in biological systems. The methyl ester functionality suggests that it can undergo hydrolysis to release L-valine, which is an essential amino acid involved in protein synthesis. The biphenyl structure may impart specific electronic properties and steric effects, making it of interest in medicinal chemistry and drug design. Additionally, the compound's solubility, stability, and reactivity can vary based on environmental conditions, which are important for its application in research and potential therapeutic uses. Overall, this compound represents a fascinating intersection of organic chemistry and biochemistry, with implications for further study in pharmacology and material science.

Formula: C₂₀H₂₂N₂O₂

InChI: InChI=1S/C20H22N2O2/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/t19-/m0/s1

InChI key: InChIKey=ZQHINOUCNQKQEV-IBGZPJMESA-N

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

Synonyms:

• (S)-Methyl 2-(((2′-cyano-[1,1′-biphenyl]-4-yl)methyl)amino)-3-methylbutanoate
• <span class="text-smallcaps">L</span>-Valine, N-[(2′-cyano[1,1′-biphenyl]-4-yl)methyl]-, methyl ester
• N-[(2'-Cyano-(1,1'-biphenyl)-4-yl)methyl)]valine methyl ester
• N-[(2′-Cyano[1,1′-biphenyl]-4-yl)methyl]-<span class="text-smallcaps">L</span>-valine methyl ester
• methyl N-[(2'-cyanobiphenyl-4-yl)methyl]-L-valinate
• L-Valine, N-[(2′-cyano[1,1′-biphenyl]-4-yl)methyl]-, methyl ester
• N-[(2′-Cyano[1,1′-biphenyl]-4-yl)methyl]-L-valine methyl ester

N-(2'-Cyanobiphenyl-4-ylmethyl)-L-valine Methyl Ester Hydrochloride

CAS: 137863-89-9, 482577-59-3

Formula: C₂₀H₂₂N₂O₂·HCl

Purity: >98.0%(T)(HPLC)

Color and Shape: White to Almost white powder to crystal

Molecular weight: 358.87

Ref: 3B-C2475

(S)-Methyl 2-(((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)amino)-3-methylbutanoate

CAS: 137863-89-9

Formula: C₂₀H₂₂N₂O₂

Molecular weight: 322.4009

Ref: IN-DA0013ZX