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Substance Name: 2,4,6-Cycloheptatrien-1-one, 5,7-bis(morpholinomethyl)-2-hydroxy-3-isopropyl-, dihydrochloride
RN: 36170-25-9
InChIKey: IPNDWAYKBVVIBI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H30-N2-O4.2Cl-H

Molecular Weight

  • 435.389
 
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Names and Synonyms

Synonyms

  • 3-Isopropyl-5,7-dimorpholinomethyltropolone dihydrochloride
  • 5,7-Bis(morpholinomethyl)-2-hydroxy-3-isopropyl-2,4,6-cycloheptatrien-1-one dihydrochloride
  • IDMT

Systematic Name

  • 2,4,6-Cycloheptatrien-1-one, 5,7-bis(morpholinomethyl)-2-hydroxy-3-isopropyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 36170-25-9

Related Registry Number

  • 34723-12-1 (Parent)

System Generated Number

  • 0036170259

Molecular Formulas

Molecular Formula

  • C20-H30-N2-O4.2Cl-H

Molecular Formula Fragments

  • C20-H30-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H30N2O4.2ClH/c1-15(2)18-12-16(13-21-3-7-25-8-4-21)11-17(19(23)20(18)24)14-22-5-9-26-10-6-22;;/h11-12,15H,3-10,13-14H2,1-2H3,(H,23,24);2*1H

InChIKey

IPNDWAYKBVVIBI-UHFFFAOYSA-N

Smiles

c1(cc(cc(c(c1=O)O)C(C)C)C[NH+]1CCOCC1)C[NH+]1CCOCC1.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: EXCITEMENT

BEHAVIORAL: ATAXIA
Yakugaku Zasshi. Journal of Pharmacy. Vol. 92, Pg. 570, 1972.
mouse LD50 intravenous 48mg/kg (48mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: EXCITEMENT

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Yakugaku Zasshi. Journal of Pharmacy. Vol. 92, Pg. 570, 1972.
mouse LD50 subcutaneous 120mg/kg (120mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: EXCITEMENT

BEHAVIORAL: ATAXIA
Yakugaku Zasshi. Journal of Pharmacy. Vol. 92, Pg. 570, 1972.