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Substance Name: Hexobendine dihydrochloride
RN: 50-62-4
UNII: P60CS4TIHV
InChIKey: GIOKUMNZQFCEPI-UHFFFAOYSA-N

Note

  • A potent vasoactive agent that dilates cerebral and coronary arteries, but slightly constricts femoral arteries, without any effects on heart rate, blood pressure or cardiac output.

Molecular Formula

  • C30-H44-N2-O10.2Cl-H

Molecular Weight

  • 665.603
 

Classification Codes

  • Cardiovascular Agents
  • Vasodilator Agents
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Names and Synonyms

Results Name

  • Hexobendine dihydrochloride

Name of Substance

  • Hexobendine dihydrochloride

Synonyms

  • Andiamine
  • Benzoic acid, 3,4,5-trimethoxy-, 1,2-ethanediylbis((methylimino)-3,1-propanediyl) ester, 2HCl
  • EINECS 200-054-7
  • Flussicor
  • Hexobendine dihydrochloride
  • Hexobendine HCl
  • N,N'-Dimethyl-N,N'-bis(3-(3',4',5'-trimethoxybenzoxy)propyl)ethylenediamine dihydrochloride
  • Reoxyl
  • UNII-P60CS4TIHV
  • Ustimon

Systematic Names

  • Benzoic acid, 3,4,5-trimethoxy-, diester with 3,3'-(ethylenebis(methylimino))di-1-propanol, dihydrochloride
  • Hexobendine dihydrochloride

Registry Numbers

CAS Registry Number

  • 50-62-4

FDA UNII

  • P60CS4TIHV

System Generated Number

  • 0000050624

Molecular Formulas

Molecular Formula

  • C30-H44-N2-O10.2Cl-H

Molecular Formula Fragments

  • C30-H44-N2-O10
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C30H44N2O10.2ClH/c1-31(11-9-15-41-29(33)21-17-23(35-3)27(39-7)24(18-21)36-4)13-14-32(2)12-10-16-42-30(34)22-19-25(37-5)28(40-8)26(20-22)38-6;;/h17-20H,9-16H2,1-8H3;2*1H

InChIKey

GIOKUMNZQFCEPI-UHFFFAOYSA-N

Smiles

c1(c(cc(C(OCCC[N@@](CC[N@@](CCCOC(c2cc(c(OC)c(c2)OC)OC)=O)C)C)=O)cc1OC)OC)OC.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 35200ug/kg (35.2mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Gendai no Rinsho. Vol. 3, Pg. 77, 1969.
mouse LD50 oral 682mg/kg (682mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Gendai no Rinsho. Vol. 3, Pg. 77, 1969.
mouse LD50 subcutaneous 328mg/kg (328mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

SKIN AND APPENDAGES (SKIN): HAIR: OTHER

BEHAVIORAL: TREMOR
Gendai no Rinsho. Vol. 3, Pg. 77, 1969.
rat LD50 intravenous 52mg/kg (52mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Gendai no Rinsho. Vol. 3, Pg. 77, 1969.
rat LD50 oral 2550mg/kg (2550mg/kg) SKIN AND APPENDAGES (SKIN): HAIR: OTHER

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR
Gendai no Rinsho. Vol. 3, Pg. 77, 1969.
rat LD50 subcutaneous 930mg/kg (930mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Gendai no Rinsho. Vol. 3, Pg. 77, 1969.