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Substance Name: Benzamide, 2,6-dimethoxy-N-(1-(2-(1H-indol-3-yl)ethyl)-4-piperidinyl)-, hydrochloride, hydrate (2:2:1)
RN: 36623-81-1
InChIKey: BDPAMZLIXDHCJE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H29-N3-O3.Cl-H.1/2H2-O

Molecular Weight

  • 443.972
 
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Names and Synonyms

Synonym

  • 2,6-Dimethoxy-N-(1-(2-(1H-indol-3-yl)ethyl)-4-piperidinyl)benzamide hydrochloride hemihydrate

Systematic Name

  • Benzamide, 2,6-dimethoxy-N-(1-(2-(1H-indol-3-yl)ethyl)-4-piperidinyl)-, hydrochloride, hydrate (2:2:1)

Registry Numbers

CAS Registry Number

  • 36623-81-1

System Generated Number

  • 0036623811

Molecular Formulas

Molecular Formula

  • C24-H29-N3-O3.Cl-H.1/2H2-O

Molecular Formula Fragments

  • C24-H29-N3-O3
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C24H29N3O3.ClH/c1-29-21-8-5-9-22(30-2)23(21)24(28)26-18-11-14-27(15-12-18)13-10-17-16-25-20-7-4-3-6-19(17)20;/h3-9,16,18,25H,10-15H2,1-2H3,(H,26,28);1H

InChIKey

BDPAMZLIXDHCJE-UHFFFAOYSA-N

Smiles

C(c1c(cccc1OC)OC)(=O)NC1CCN(CC1)CCc1c[nH]c2ccccc12.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 127mg/kg (127mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 1054, 1971.