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Substance Name: 1,3-Benzodioxole, 2-(2-(2-(diethylamino)ethylamino)propyl)-2-methyl-, dimaleate
RN: 78186-57-9
InChIKey: ZRMIOFMPDYFICW-SPIKMXEPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H28-N2-O2.2C4-H4-O4

Molecular Weight

  • 524.563
 
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Names and Synonyms

Synonym

  • 2-(2-(2-(Diethylamino)ethylamino)propyl)-2-methyl-1,3-benzodioxole dimaleate

Systematic Name

  • 1,3-Benzodioxole, 2-(2-(2-(diethylamino)ethylamino)propyl)-2-methyl-, dimaleate

Registry Numbers

CAS Registry Number

  • 78186-57-9

System Generated Number

  • 0078186579

Molecular Formulas

Molecular Formula

  • C17-H28-N2-O2.2C4-H4-O4

Molecular Formula Fragments

  • C17-H28-N2-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H28N2O2.2C4H4O4/c1-5-19(6-2)12-11-18-14(3)13-17(4)20-15-9-7-8-10-16(15)21-17;2*5-3(6)1-2-4(7)8/h7-10,14,18H,5-6,11-13H2,1-4H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

InChIKey

ZRMIOFMPDYFICW-SPIKMXEPSA-N

Smiles

C1(Oc2ccccc2O1)(C[C@@H]([NH2+]CC[NH+](CC)CC)C)C.C(=C/C(=O)[O-])\C(O)=O.C(=C/C(=O)[O-])\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 413, 1977.