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Substance Name: Isonipecotamide, 1-(3-(2-chlorophenothiazin-10-yl)propyl)-4-piperidino-, hydrochloride, methanol (1:2:1)
RN: 13805-43-1
InChIKey: JIQNFRJKNZJYQZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H33-Cl-N4-O-S.2Cl-H.C-H4-O

Molecular Weight

  • 558.015
 
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Names and Synonyms

  • Isonipecotamide, 1-(3-(2-chlorophenothiazin-10-yl)propyl)-4-piperidino-, hydrochloride, methanol (1:2:1)

Registry Numbers

CAS Registry Number

  • 13805-43-1

System Generated Number

  • 0013805431

Molecular Formulas

Molecular Formula

  • C26-H33-Cl-N4-O-S.2Cl-H.C-H4-O

Molecular Formula Fragments

  • C-H4-O
  • C26-H33-Cl-N4-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H33ClN4OS.2ClH/c27-20-9-10-24-22(19-20)31(21-7-2-3-8-23(21)33-24)16-6-13-29-17-11-26(12-18-29,25(28)32)30-14-4-1-5-15-30;;/h2-3,7-10,19H,1,4-6,11-18H2,(H2,28,32);2*1H

InChIKey

JIQNFRJKNZJYQZ-UHFFFAOYSA-N

Smiles

C1(N2CCCCC2)(CCN(CCCN2c3c(Sc4c2cccc4)ccc(c3)Cl)CC1)C(N)=O.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 80mg/kg (80mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: ANTIANXIETY

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Journal of Medicinal Chemistry. Vol. 13, Pg. 644, 1970.