Chemical Compound

CHEMBL5804962

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CHEMBL5804962 chemical structure
Primary Record

CHEMBL5804962

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
135157059
SMILES
CC1=C(SC=N1)C2=CC=C(C=C2)[C@H](C)NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)COCCOCCOCCOCCOCC4=NC5=CN=C(C=C5N4C(C)C)NC6=NC(=NC=C6)N7CCC(CC7)OC)O
Canonical SMILES
COC1CCN(c2nccc(Nc3cc4c(cn3)nc(COCCOCCOCCOCCOCC(=O)N[C@H](C(=O)N3C[C@H](O)C[C@H]3C(=O)N[C@@H](C)c3ccc(-c5scnc5C)cc3)C(C)(C)C)n4C(C)C)n2)CC1

Names & Synonyms

  • CHEMBL5804962
  • SCHEMBL20305636
  • BDBM494939
  • US10994015, Example 81
  • (2S,4R)-1-((S)-18-(tert-butyl)-1-(1-isopropyl-6-((2-(4-methoxypiperidin-1-yl)pyrimidin-4-yl)amino)-1H-imidazo[4,5-c]pyridin-2-yl)-16-oxo-2,5,8,11,14-pentaoxa-17-azanonadecan-19-oyl)-4-hydroxy-N—((S)-1-(4-(4-methylthiazol-5-yl)phenyl)ethyl)pyrrolidine-2-carboxamide