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Substance Name: 2-Propanol, 1-(6-(1-(1H-benzimidazol-1-yl)vinyl)phenoxy)-3-(tert-butylamino)-
RN: 85127-88-4
InChIKey: HAAUBVPBGJLBEO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N3-O2

Molecular Weight

  • 365.4743
 
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Names and Synonyms

Synonyms

  • 3-(tert-Butylamino)-1-(6-(1-(1H-benzimidazol-1-yl)vinyl)phenoxy)-2-propanol
  • BRN 5610070

Systematic Name

  • 2-Propanol, 1-(6-(1-(1H-benzimidazol-1-yl)vinyl)phenoxy)-3-(tert-butylamino)-

Registry Numbers

CAS Registry Number

  • 85127-88-4

System Generated Number

  • 0085127884

Structure Descriptors

InChI

1S/C22H27N3O2/c1-16(25-15-23-19-10-6-7-11-20(19)25)18-9-5-8-12-21(18)27-14-17(26)13-24-22(2,3)4/h5-12,15,17,24,26H,1,13-14H2,2-4H3

InChIKey

HAAUBVPBGJLBEO-UHFFFAOYSA-N

Smiles

CC(C)(C)NCC(COc1ccccc1C(=C)n2cnc3c2cccc3)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 26500ug/kg (26.5mg/kg)   Journal of Medicinal Chemistry. Vol. 27, Pg. 1142, 1984.