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Substance Name: 2(1H)-Isoquinolinemethanamine, 3,4-dihydro-6,7-dimethoxy-N-(4-fluorophenyl)-1-(1H-indol-3-ylmethyl)-
RN: 84218-40-6
InChIKey: ODINKNVMGIPCHL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H28-F-N3-O2

Molecular Weight

  • 445.5352
 
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Names and Synonyms

  • 2(1H)-Isoquinolinemethanamine, 3,4-dihydro-6,7-dimethoxy-N-(4-fluorophenyl)-1-(1H-indol-3-ylmethyl)-

Registry Numbers

CAS Registry Number

  • 84218-40-6

System Generated Number

  • 0084218406

Structure Descriptors

InChI

1S/C27H28FN3O2/c1-32-26-14-18-11-12-31(17-30-21-9-7-20(28)8-10-21)25(23(18)15-27(26)33-2)13-19-16-29-24-6-4-3-5-22(19)24/h3-10,14-16,25,29-30H,11-13,17H2,1-2H3

InChIKey

ODINKNVMGIPCHL-UHFFFAOYSA-N

Smiles

COc1cc2c(cc1OC)C(N(CC2)CNc3ccc(cc3)F)Cc4c[nH]c5c4cccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 32, Pg. 1233, 1982.