Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 4,5-Dihydro-1,3-dimethyl-1,H-pyrazolo-(3,4-b)(1,4)-benzoxazepine
RN: 34375-78-5
UNII: 75176RT36J
InChIKey: LQIWITKKFTZURO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H13-N3-O.Cl-H

Molecular Weight

  • 251.716
 
* 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

Name of Substance

  • 4,5-Dihydro-1,3-dimethyl-1,H-pyrazolo-(3,4-b)(1,4)-benzoxazepine

Synonyms

  • 4,5-Dihydro-1,3-dimethyl-1H-pyrazolo(3,4-b)(1,4)benzoxazepin hydrochloride
  • A 29981
  • UNII-75176RT36J

Systematic Name

  • 1H-Pyrazolo(3,4-b)(1,4)-benzoxazepine, 4,5-dihydro-1,3-dimethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 34375-78-5

FDA UNII

  • 75176RT36J

System Generated Number

  • 0034375785

Molecular Formulas

Molecular Formula

  • C12-H13-N3-O.Cl-H

Molecular Formula Fragments

  • C12-H13-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H13N3O.ClH/c1-8-11-12(15(2)14-8)16-10-6-4-3-5-9(10)7-13-11;/h3-6,13H,7H2,1-2H3;1H

InChIKey

LQIWITKKFTZURO-UHFFFAOYSA-N

Smiles

O1c2c(NCc3c1cccc3)c(nn2C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 465mg/kg (465mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 202, Pg. 119, 1973.
mouse LD50 intravenous 220mg/kg (220mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 202, Pg. 119, 1973.
mouse LD50 oral 1276mg/kg (1276mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 202, Pg. 119, 1973.
rat LD50 oral 1360mg/kg (1360mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 202, Pg. 119, 1973.