XL388-C2-amide-PEG9-NH2 TFA

For research use only. Not for therapeutic Use.

  • CAT Number: I042842
  • Molecular Formula: C45H63F4N5O15S
  • Molecular Weight: 1022.06
  • Purity: ≥95%
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XL388-C2-amide-PEG9-NH2 TFA(Cat No.:I042842)is a complex peptide-based compound designed for targeted therapeutic applications. It features a PEG9 linker, providing solubility and flexibility, while the amide group enables stable peptide bonding. The compound includes XL388, a selective inhibitor, known for its role in modulating specific protein targets involved in cancer and metabolic disease pathways. The TFA (trifluoroacetic acid) salt form ensures the compound’s stability during synthesis and storage. XL388-C2-amide-PEG9-NH2 TFA is primarily used in research to explore targeted inhibition and drug delivery in oncology and metabolic disease treatments.


Synonyms

3-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-[2-[4-[7-(6-aminopyridin-3-yl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]-2-fluoro-3-methylphenyl]sulfonylethyl]propanamide;2,2,2-trifluoroacetic acid

Molecular Formula C45H63F4N5O15S
Purity ≥95%
IUPAC Name 3-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-[2-[4-[7-(6-aminopyridin-3-yl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]-2-fluoro-3-methylphenyl]sulfonylethyl]propanamide;2,2,2-trifluoroacetic acid
InChI InChI=1S/C43H62FN5O13S.C2HF3O2/c1-33-37(43(51)49-11-14-62-38-5-2-34(30-36(38)32-49)35-3-7-40(46)48-31-35)4-6-39(42(33)44)63(52,53)29-10-47-41(50)8-12-54-15-17-56-19-21-58-23-25-60-27-28-61-26-24-59-22-20-57-18-16-55-13-9-45;3-2(4,5)1(6)7/h2-7,30-31H,8-29,32,45H2,1H3,(H2,46,48)(H,47,50);(H,6,7)
InChIKey NLQUSQAYICZPJU-UHFFFAOYSA-N
SMILES CC1=C(C=CC(=C1F)S(=O)(=O)CCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCN)C(=O)N2CCOC3=C(C2)C=C(C=C3)C4=CN=C(C=C4)N.C(=O)(C(F)(F)F)O

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