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Substance Name: 1,3,8-Triazaspiro(4,5)decane-3-carboxamide, 8-(3-(p-fluorobenzoyl)propyl)-N-methyl-4-oxo-1-phenyl-, hydrochloride
RN: 54286-36-1
InChIKey: IQBBWFFCFSPVNO-UHFFFAOYSA-N

Molecular Formula

  • C25-H29-F-N4-O3.Cl-H

Molecular Weight

  • 488.988
 
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Names and Synonyms

  • 1,3,8-Triazaspiro(4,5)decane-3-carboxamide, 8-(3-(p-fluorobenzoyl)propyl)-N-methyl-4-oxo-1-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 54286-36-1

System Generated Number

  • 0054286361

Molecular Formulas

Molecular Formula

  • C25-H29-F-N4-O3.Cl-H

Molecular Formula Fragments

  • C25-H29-F-N4-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H29FN4O3.ClH/c1-27-24(33)29-18-30(21-6-3-2-4-7-21)25(23(29)32)13-16-28(17-14-25)15-5-8-22(31)19-9-11-20(26)12-10-19;/h2-4,6-7,9-12H,5,8,13-18H2,1H3,(H,27,33);1H

InChIKey

IQBBWFFCFSPVNO-UHFFFAOYSA-N

Smiles

CNC(=O)N1CN(C2(C1=O)CCN(CC2)CCCC(=O)c3ccc(cc3)F)c4ccccc4.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 28mg/kg (28mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#11903,