Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2H-1,4-Benzodiazepin-2-one, 1,3,4,5-tetrahydro-5-(acetyloxy)-4,7-dinitro-5-phenyl-
RN: 62658-10-0
InChIKey: BIPBWKRVOQYJMX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H14-N4-O7

Molecular Weight

  • 386.3186
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 1,3,4,5-Tetrahydro-5-(acetyloxy)-4,7-dinitro-5-phenyl-2H-1,4-benzodiazepin-2-one
  • 5-25-02-00183 (Beilstein Handbook Reference)
  • 5-Acetoxy-4,7-dinitro-5-phenyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
  • BRN 0904224

Systematic Name

  • 2H-1,4-Benzodiazepin-2-one, 1,3,4,5-tetrahydro-5-(acetyloxy)-4,7-dinitro-5-phenyl-

Registry Numbers

CAS Registry Number

  • 62658-10-0

System Generated Number

  • 0062658100

Structure Descriptors

InChI

1S/C17H14N4O7/c1-11(22)28-17(12-5-3-2-4-6-12)14-9-13(20(24)25)7-8-15(14)18-16(23)10-19(17)21(26)27/h2-9H,10H2,1H3,(H,18,23)

InChIKey

BIPBWKRVOQYJMX-UHFFFAOYSA-N

Smiles

CC(=O)OC1(c2cc(ccc2NC(=O)CN1[N+](=O)[O-])[N+](=O)[O-])c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 776, 1977.