Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Mitozolomide [INN:BAN]
RN: 85622-95-3
UNII: E3U7286V3W
InChIKey: QXYYYPFGTSJXNS-UHFFFAOYSA-N

Classification Codes

  • Antineoplastic Agents
  • Drug / Therapeutic Agent
  • Human Data
  • Mutation Data
  • Reproductive Effect

Molecular Formula

  • C7-H7-Cl-N6-O2

Molecular Weight

  • 242.6253
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Mitozolomide
  • Mitozolomide [INN:BAN]

Synonyms

  • 3-(2-Chloroethyl)-3,4-dihydro-4-oxoimidazo(5,1-d)-1,2,3,5-tetrazine-8-carboxamide
  • 3-(2-Chloroethyl)-3,4-dihydro-4-oxoimidazo(5,1-d)-as-tetrazine-8-carboxamide
  • 8-Carbamoyl-3-(2-chloroethyl)imidazo(5,1-d)-1,2,3,5-tetrazin-4(3H)-one
  • Azolastone
  • BRN 3618072
  • CCRG 81010
  • EINECS 287-943-3
  • M & B 39565
  • Mitozolamide
  • Mitozolomida
  • Mitozolomida [Spanish]
  • Mitozolomide
  • Mitozolomidum
  • Mitozolomidum [Latin]
  • NSC 353451
  • UNII-E3U7286V3W

Systematic Names

  • 3-(2-Chloroethyl)-3,4-dihydro-4-oxoimidazo(5,1-d)-as-tetrazine-8-carboxamide
  • Imidazo(5,1-d)-1,2,3,5-tetrazine-8-carboxamide, 3-(2-chloroethyl)-3,4-dihydro-4-oxo-
  • Mitozolomide

Registry Numbers

CAS Registry Number

  • 85622-95-3

FDA UNII

  • E3U7286V3W

System Generated Number

  • 0085622953

Structure Descriptors

InChI

1S/C7H7ClN6O2/c8-1-2-14-7(16)13-3-10-4(5(9)15)6(13)11-12-14/h3H,1-2H2,(H2,9,15)

InChIKey

QXYYYPFGTSJXNS-UHFFFAOYSA-N

Smiles

NC(=O)c1ncn2C(=O)N(CCCl)N=Nc12

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
human TDLo oral 3108ug/kg (3.108mg/kg) BLOOD: CHANGES IN BONE MARROW NOT INCLUDED ABOVE

GASTROINTESTINAL: NAUSEA OR VOMITING
British Journal of Cancer. Vol. 55, Pg. 433, 1987.
mouse LD10 intraperitoneal 45mg/kg (45mg/kg) BLOOD: CHANGES IN BONE MARROW NOT INCLUDED ABOVE

BLOOD: CHANGES IN CELL COUNT (UNSPECIFIED)
British Journal of Cancer. Vol. 58, Pg. 139, 1988.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.47 (none)   EXP
Water Solubility 1190 mg/L 25 EST
Vapor Pressure 7.58E-11 mm Hg 25 EST
Henry's Law Constant 3.74E-14 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.68E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.