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Substance Name: 1H-Isoindol-1-one, 2,3-dihydro-2-(2-(diethylamino)ethyl)-3-(2-(dimethylamino)phenyl)-, dihydrochloride
RN: 116870-78-1
InChIKey: HPJCNJBAHRYCBI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-N3-O.2Cl-H

Molecular Weight

  • 424.4129
 
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Names and Synonyms

Synonym

  • 2-(2-Diethylaminoethyl)-3-(2-dimethylaminophenyl)isoindolin-1-one dihydrochloride

Systematic Name

  • 1H-Isoindol-1-one, 2,3-dihydro-2-(2-(diethylamino)ethyl)-3-(2-(dimethylamino)phenyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 116870-78-1

System Generated Number

  • 0116870781

Molecular Formulas

Molecular Formula

  • C22-H29-N3-O.2Cl-H

Molecular Formula Fragments

  • C22-H29-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H29N3O.2ClH/c1-5-24(6-2)15-16-25-21(17-11-7-8-12-18(17)22(25)26)19-13-9-10-14-20(19)23(3)4;;/h7-14,21H,5-6,15-16H2,1-4H3;2*1H

InChIKey

HPJCNJBAHRYCBI-UHFFFAOYSA-N

Smiles

CCN(CC)CCN1C(c2ccccc2C1=O)c3ccccc3N(C)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 50mg/kg (50mg/kg)   United States Patent Document. Vol. #4849441,
mouse LDLo oral 100mg/kg (100mg/kg)   United States Patent Document. Vol. #4849441,