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Substance Name: Pyrazolo(4,3-f)pyrrolo(1,2-a)(1,4)diazepine, 1,4,5,6-tetrahydro-1-methyl-6-(4-nitrophenyl)-
RN: 156032-63-2
InChIKey: KTTCWBBJGMMXLP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H15-N5-O2

Molecular Weight

  • 309.3275
 
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Names and Synonyms

Synonyms

  • 1,4,5,6-Tetrahydro-1-methyl-6-(4-nitrophenyl)pyrazolo(4,3-f)pyrrolo(1,2-a)(1,4)diazepine
  • 5,6-Dihydro-6-(4-nitrophenyl)-1-methyl-1H,4H-pyrazolo(4,3-f)pyrrolo(1,2-a)(1,4)diazepine

Systematic Name

  • Pyrazolo(4,3-f)pyrrolo(1,2-a)(1,4)diazepine, 1,4,5,6-tetrahydro-1-methyl-6-(4-nitrophenyl)-

Registry Numbers

CAS Registry Number

  • 156032-63-2

System Generated Number

  • 0156032632

Structure Descriptors

InChI

1S/C16H15N5O2/c1-19-16-12(10-18-19)9-17-15(14-3-2-8-20(14)16)11-4-6-13(7-5-11)21(22)23/h2-8,10,15,17H,9H2,1H3

InChIKey

KTTCWBBJGMMXLP-UHFFFAOYSA-N

Smiles

Cn1c-2c(cn1)CNC(c3n2ccc3)c4ccc(cc4)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 29, Pg. 233, 1994.