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Substance Name: 1-Propanol, 3-((4,5-dihydro-1H-imidazol-2-yl)((2-phenyl-1H-indol-3-yl)methyl)amino)-, monohydroiodide
RN: 77587-77-0
InChIKey: IXGKSZWGEXIHRE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H24-N4-O.H-I

Molecular Weight

  • 476.3555
 
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Names and Synonyms

Synonym

  • 2-Phenyl-3-((N-propan-3-ol-N-imidazolin-2-ylamino)methyl)indole hydroiodide

Systematic Name

  • 1-Propanol, 3-((4,5-dihydro-1H-imidazol-2-yl)((2-phenyl-1H-indol-3-yl)methyl)amino)-, monohydroiodide

Registry Numbers

CAS Registry Number

  • 77587-77-0

System Generated Number

  • 0077587770

Molecular Formulas

Molecular Formula

  • C21-H24-N4-O.H-I

Molecular Formula Fragments

  • C21-H24-N4-O
  • COMPONENT
  • H-I

Structure Descriptors

InChI

1S/C21H24N4O.HI/c26-14-6-13-25(21-22-11-12-23-21)15-18-17-9-4-5-10-19(17)24-20(18)16-7-2-1-3-8-16;/h1-5,7-10,24,26H,6,11-15H2,(H,22,23);1H

InChIKey

IXGKSZWGEXIHRE-UHFFFAOYSA-N

Smiles

c1ccc(cc1)c2c(c3ccccc3[nH]2)CN(CCCO)C4=NCCN4.I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Pharmazie. Vol. 35, Pg. 742, 1980.