Chemical Compound

Vonoprazan Fumarate

CAS Registry Number1260141-27-2
Vonoprazan Fumarate chemical structure
Primary record

Vonoprazan Fumarate

CAS
1260141-27-2
PubChem CID
45375887
SMILES
CNCC1=CN(C(=C1)C2=CC=CC=C2F)S(=O)(=O)C3=CN=CC=C3.C(=C/C(=O)O)\C(=O)O
Molecular Formula
C21H20FN3O6S
Molecular Weight
461.471
Exact Mass
461.1057
InChI
InChI=1S/C17H16FN3O2S.C4H4O4/c1-19-10-13-9-17(15-6-2-3-7-16(15)18)21(12-13)24(22,23)14-5-4-8-20-11-14;5-3(6)1-2-4(7)8/h2-9,11-12,19H,10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKey
ROGSHYHKHPCCJW-WLHGVMLRSA-N
LogP
2.3574
TPSA
138.59

Names and synonyms

  • Vonoprazan Fumarate
  • TAK-438
  • Vonoprazan fumurate
  • Vonoprazan
  • 1260141-27-2
  • 881681-01-2
  • takecab
  • Vocinti
  • VOQUEZNA
  • TAK-438 monofumarate
  • Voquezna (TN)
  • Vonoprazan monofumarate
  • Vonoprazan monofumurate
  • Takecab (TN)
  • Vonoprazan (Fumarate)
  • UNII-4QW3X4AMLB
  • Tube601
  • Vonoprazan-d4 Fumarate
  • 4QW3X4AMLB
  • TAK438
  • TAK 438
  • Vonoprazan Fumarate (TAK-438)
  • Vonoprazan fumarate [USAN]
  • MFCD18633280
  • D02CPP
  • C21H20FN3O6S
  • 1-(5-(2-fluorophenyl)-1-(pyridin-3-ylsulfonyl)-1H-pyrrol-3-yl)-N-methylmethanamine fumarate
  • SCHEMBL194394
  • orb1305537
  • orb1306422