Chemical Compound

Sitamaquine

CAS Registry Number57695-04-2
Sitamaquine chemical structure
Primary record

Sitamaquine

CAS
57695-04-2
PubChem CID
42548
SMILES
CCN(CC)CCCCCCNC1=CC(=CC2=C(C=CN=C12)C)OC
Molecular Formula
C21H33N3O
Molecular Weight
343.515
Exact Mass
343.2624
InChI
InChI=1S/C21H33N3O/c1-5-24(6-2)14-10-8-7-9-12-22-20-16-18(25-4)15-19-17(3)11-13-23-21(19)20/h11,13,15-16,22H,5-10,12,14H2,1-4H3
InChIKey
RVAKDGYPIVSYEU-UHFFFAOYSA-N
LogP
4.8659
TPSA
37.39

Names and synonyms

  • Sitamaquine
  • Sitamaquina
  • sitamaquinum
  • Sitamaquine HCl
  • Sitamaquine [BAN]
  • 5AIJ4TGC6B
  • Sitamaquine [INN:BAN]
  • sitamaquine dihydrochloride
  • UNII-5AIJ4TGC6B
  • WR 6026 dihydrochloride
  • sitamaquine hydrochloride
  • SITAMAQUINE [MI]
  • RefChem:886376
  • SITAMAQUINE [INN]
  • 57695-04-2
  • WR-6026
  • WR6026
  • D0Q1LO
  • UNII-ASU02O7NS8
  • SITAMAQUINE [WHO-DD]
  • C21H33N3O.2ClH
  • CHEMBL57004
  • DTXSID70206395
  • orb2815242
  • SCHEMBL1070741
  • DRG-0140
  • SCHEMBL29811198
  • WR 6026
  • DTXCID70128886
  • NSC2452