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Substance Name: Benzoic acid, p-(3-(2-(dimethylamino)ethoxy)-1H-indazol-1-yl)-, butyl ester
RN: 20954-12-5
InChIKey: VZXXAZKSJMKSPJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N3-O3

Molecular Weight

  • 381.473
 
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Names and Synonyms

Synonyms

  • BRN 0847133
  • ITF 631
  • p-(3-(2-(Dimethylamino)ethoxy)-1H-indazol-1-yl)benzoic acid butyl ester

Systematic Name

  • Benzoic acid, p-(3-(2-(dimethylamino)ethoxy)-1H-indazol-1-yl)-, butyl ester

Registry Numbers

CAS Registry Number

  • 20954-12-5

System Generated Number

  • 0020954125

Structure Descriptors

InChI

1S/C22H27N3O3/c1-4-5-15-28-22(26)17-10-12-18(13-11-17)25-20-9-7-6-8-19(20)21(23-25)27-16-14-24(2)3/h6-13H,4-5,14-16H2,1-3H3

InChIKey

VZXXAZKSJMKSPJ-UHFFFAOYSA-N

Smiles

n1(c2c(cccc2)c(n1)OCCN(C)C)c1ccc(C(OCCCC)=O)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 375mg/kg (375mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR
Farmaco, Edizione Scientifica. Vol. 24, Pg. 965, 1969.
rat LD50 oral > 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 24, Pg. 965, 1969.