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Substance Name: Enpiroline phosphate [USAN]
RN: 66364-74-7
UNII: QX39IR9V1D
InChIKey: YCAFBJQXADKUSD-RVXRQPKJSA-N

Classification Codes

  • Antimalarial
  • Drug / Therapeutic Agent

Molecular Formulas

  • C19-H18-F6-N2-O.H3-O4-P
  • C19-H18-F6-N2-O.H3-P-O4

Molecular Weight

  • 502.3459
 
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Names and Synonyms

Name of Substance

  • Enpiroline
  • Enpiroline phosphate [USAN]

Synonyms

  • (+-)-(R*,R*)-alpha-(2-(Trifluoromethyl)-6-(alpha,alpha,alpha-trifluoro-p-tolyl)-4-pyridyl)-2-piperidinemethanol phosphate (1:1) (salt)
  • 4-Pyridinemethanol, alpha-(2-piperidinyl)-2-(trifluoromethyl)-6-(4-(trifluoromethyl)phenyl)-, (R*,R*)-(+-)-, phosphate (1:1) (salt)
  • Enpiroline phosphate
  • UNII-QX39IR9V1D
  • WR 180,409
  • WR 180409

Systematic Names

  • 4-Pyridinemethanol, alpha-(2-piperidinyl)-2-(trifluoromethyl)-6-(4-(trifluoromethyl)phenyl)-, (R*,R*)-(+-)-, phosphate (1:1) (salt)
  • 4-Pyridinemethanol, alpha-2-piperidinyl-2-(trifluoromethyl)-6-(4-(trifluoromethyl)phenyl)-, phosphate

Registry Numbers

CAS Registry Number

  • 66364-74-7

FDA UNII

  • QX39IR9V1D

Other Registry Number

  • 64691-55-0

System Generated Number

  • 0066364747

Molecular Formulas

Molecular Formulas

  • C19-H18-F6-N2-O.H3-O4-P
  • C19-H18-F6-N2-O.H3-P-O4

Molecular Formula Fragments

  • C19-H18-F6-N2-O
  • COMPONENT
  • H3-O4-P
  • H3-P-O4

Structure Descriptors

InChI

1S/C19H18F6N2O.H3O4P/c20-18(21,22)13-6-4-11(5-7-13)15-9-12(10-16(27-15)19(23,24)25)17(28)14-3-1-2-8-26-14;1-5(2,3)4/h4-7,9-10,14,17,26,28H,1-3,8H2;(H3,1,2,3,4)/t14-,17-;/m0./s1

InChIKey

YCAFBJQXADKUSD-RVXRQPKJSA-N

Smiles

O[C@H]([C@@H]1CCCCN1)c2cc(nc(c2)C(F)(F)F)c3ccc(cc3)C(F)(F)F.OP(=O)(O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 518mg/kg (518mg/kg)   Acta Tropica. Vol. 37, Pg. 232, 1980.
rat LD50 oral 518mg/kg (518mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING Acta Tropica. Vol. 37, Pg. 232, 1980.