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Substance Name: 2-Propanol, 1-((2-(3,4-dimethoxyphenyl)ethyl)amino)-3-(3-thienyloxy)-
RN: 76142-64-8
InChIKey: CCKDSJAVUWFBTL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H23-N-O4-S

Molecular Weight

  • 337.4377
 
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Names and Synonyms

Synonyms

  • 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(3-thienyloxy)-2-propanol
  • BRN 5105642

Systematic Name

  • 2-Propanol, 1-((2-(3,4-dimethoxyphenyl)ethyl)amino)-3-(3-thienyloxy)-

Registry Numbers

CAS Registry Number

  • 76142-64-8

System Generated Number

  • 0076142648

Structure Descriptors

InChI

1S/C17H23NO4S/c1-20-16-4-3-13(9-17(16)21-2)5-7-18-10-14(19)11-22-15-6-8-23-12-15/h3-4,6,8-9,12,14,18-19H,5,7,10-11H2,1-2H3

InChIKey

CCKDSJAVUWFBTL-UHFFFAOYSA-N

Smiles

COc1ccc(cc1OC)CCNCC(COc2ccsc2)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 200mg/kg (200mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 18, Pg. 151, 1983.
mouse LD50 intravenous > 75mg/kg (75mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 18, Pg. 151, 1983.