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Substance Name: Acetamide, 2-(4-(4,4-bis(p-fluorophenyl)butyl)piperazinyl)-N-isobutyl- N-(4'-phenylcyclohexyl)-, dihydrochloride, (E)-
RN: 63698-43-1
InChIKey: QAIXSBNSBPEZKG-PYQPNVONSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C38-H49-F2-N3-O.2Cl-H

Molecular Weight

  • 674.7429
 
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Names and Synonyms

Synonym

  • M.G. 18016-2HCl

Systematic Name

  • Acetamide, 2-(4-(4,4-bis(p-fluorophenyl)butyl)piperazinyl)-N-isobutyl- N-(4'-phenylcyclohexyl)-, dihydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 63698-43-1

System Generated Number

  • 0063698431

Molecular Formulas

Molecular Formula

  • C38-H49-F2-N3-O.2Cl-H

Molecular Formula Fragments

  • C38-H49-F2-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C38H49F2N3O.2ClH/c1-29(2)27-41-38(44)28-42-22-25-43(26-23-42,36-20-14-31(15-21-36)30-7-4-3-5-8-30)24-6-9-37(32-10-16-34(39)17-11-32)33-12-18-35(40)19-13-33;;/h3-5,7-8,10-13,16-19,25,29,31,36-37H,6,9,14-15,20-24,26-28H2,1-2H3,(H,41,44);2*1H/t31-,36-,43?;;

InChIKey

QAIXSBNSBPEZKG-PYQPNVONSA-N

Smiles

CC(CNC(=O)CN1CC=N(CC1)([C@H]2CC[C@@H](CC2)c3ccccc3)CCCC(c4ccc(cc4)F)c5ccc(cc5)F)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 55mg/kg (55mg/kg)   Farmaco, Edizione Scientifica. Vol. 32, Pg. 461, 1977.