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Substance Name: 2H-Isoindole-2-hexanamide, 1,3-dihydro-N-(3,5-dimethyl-1-(4-nitrophenyl)-1H-indol-2-yl)-1,3-dioxo-
RN: 138349-46-9
InChIKey: JBWNPYNELPDCKB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H28-N4-O5

Molecular Weight

  • 524.5742
 
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Names and Synonyms

Synonym

  • BRN 5466757

Systematic Name

  • 2H-Isoindole-2-hexanamide, 1,3-dihydro-N-(3,5-dimethyl-1-(4-nitrophenyl)-1H-indol-2-yl)-1,3-dioxo-

Registry Numbers

CAS Registry Number

  • 138349-46-9

System Generated Number

  • 0138349469

Structure Descriptors

InChI

1S/C30H28N4O5/c1-19-11-16-26-25(18-19)20(2)28(33(26)21-12-14-22(15-13-21)34(38)39)31-27(35)10-4-3-7-17-32-29(36)23-8-5-6-9-24(23)30(32)37/h5-6,8-9,11-16,18H,3-4,7,10,17H2,1-2H3,(H,31,35)

InChIKey

JBWNPYNELPDCKB-UHFFFAOYSA-N

Smiles

Cc1ccc2c(c1)c(c(n2c3ccc(cc3)[N+](=O)[O-])NC(=O)CCCCCN4C(=O)c5ccccc5C4=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 771, 1991.