Chemical Compound

CHEMBL5976046

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CHEMBL5976046 chemical structure
Primary Record

CHEMBL5976046

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
126574440
SMILES
CC1=C(C(=C(C(=N1)C)[C@@H](C(=O)O)OC(C)(C)C)N2CCC(CC2)(C)C)C3=CC4=C(CN(CC4)C5=NC=NC6=C5C=CN6)C=C3
Canonical SMILES
Cc1nc(C)c([C@H](OC(C)(C)C)C(=O)O)c(N2CCC(C)(C)CC2)c1-c1ccc2c(c1)CCN(c1ncnc3[nH]ccc13)C2

Names & Synonyms

  • CHEMBL5976046
  • SCHEMBL18498584
  • BDBM432125
  • US10577353, Compound 20
  • (2S)-2-tert-butoxy-2-[4-(4,4-dimethyl-1-piperidyl)-2,6-dimethyl-5-[2-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-3,4-dihydro-1H-isoquinolin-6-yl]-3-pyridyl]acetic acid
  • (S)-2-(5-(2-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1,2,3,4- tetrahydroisoquinolin-6-yl)-4-(4,4-dimethylpiperidin-1-yl)-2,6- dimethylpyridin-3-yl)-2-(tert-butoxy)acetic acid