Chemical Compound

CHEMBL5952268

CHEMBL5952268 chemical structure
Primary Record

CHEMBL5952268

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
121428794
SMILES
CC(C)(C)[C@H](C1=CC(=CN1CC2=CC=CC=C2)C3=C(C=CC(=C3)F)F)N(CC[C@@H](C(=O)N[C@H](CNC(=O)CNC(=O)CC(C(=O)O)SC[C@@H](C(=O)O)N)C(=O)O)N)C(=O)CO
Canonical SMILES
CC(C)(C)[C@H](c1cc(-c2cc(F)ccc2F)cn1Cc1ccccc1)N(CC[C@H](N)C(=O)N[C@H](CNC(=O)CNC(=O)CC(SC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)CO

Names & Synonyms

  • CHEMBL5952268
  • SCHEMBL17860229
  • SCHEMBL29396224
  • BDBM509091
  • US11071788, Example M3
  • 4-[(2-{[(2R)-2-({(2S)-2-Amino-4-[{(1R)-1-[1-benzyl-4-(2,5-difluorophenyl)-1H-pyrrol-2-yl]-2,2-dimethylpropyl}(glycoloyl)amino]butanoyl}amino)-2-carboxyethyl]amino}-2-oxoethyl)amino]-3-{[(2R)-2-amino-2-carboxyethyl]sulphanyl}-4-oxobutanoic acid/trifluoroacetic acid (1:1)