propyl 4-[[4-[(5-chloro-2-oxoindol-3-yl)amino]benzoyl]amino]benzoate

Names

[ CAS No. ]:
84496-07-1

[ Name ]:
propyl 4-[[4-[(5-chloro-2-oxoindol-3-yl)amino]benzoyl]amino]benzoate

Chemical & Physical Properties

[ Density]:
1.35g/cm3

[ Molecular Formula ]:
C25H20ClN3O4

[ Molecular Weight ]:
461.89700

[ Exact Mass ]:
461.11400

[ PSA ]:
100.35000

[ LogP ]:
5.75400

[ Index of Refraction ]:
1.653

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DG4995765
CHEMICAL NAME :
Benzoic acid, 4-((4-((5-chloro-1,2-dihydro-2-oxo-3H-indol-3-ylidene )amino)benzoyl)amino) -, propyl ester
CAS REGISTRY NUMBER :
84496-07-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C25-H20-Cl-N3-O4
MOLECULAR WEIGHT :
461.93

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay) Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 21,775,1982

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 5-Chloroindoline-2,3-dione
  • propyl 4-[(4'-aminobenzoyl)amino]benzoate
  • Risocaine
  • 4-Nitrobenzoyl chloride
  • propyl 4-[(4'-nitrobenzoyl)amino]benzoate

DownStream

  • propyl 4-[[4-[[5-chloro-1-(morpholin-4-ylmethyl)-2-oxoindol-3-ylidene]amino]benzoyl]amino]benzoate

Related Compounds

  • 2,2-Difluoro-1-(5-methoxypyridin-2-yl)ethan-1-amine
  • [3-Fluoro-1-(propane-1-sulfonyl)azetidin-3-yl]methanamine
  • (1R)-1-(3-cyclobutyl-1-methyl-1H-pyrazol-5-yl)ethan-1-amine
  • 2-[4-Chloro-3-(trifluoromethyl)phenyl]-3,3-difluoropropan-1-amine
  • (2R)-1-[2-(difluoromethoxy)-3-methylphenyl]propan-2-amine
  • 2-(2,5-Dimethoxypyridin-4-yl)-2-methoxypropan-1-amine
  • (2R)-4-(2-methyl-2H-indazol-3-yl)butan-2-amine
  • 2-[1-(4-chloro-1-ethyl-1H-imidazol-5-yl)cyclopropyl]propan-2-amine
  • 3-(4-Amino-1H-benzo[d][1,2,3]triazol-1-yl)thietane 1,1-dioxide
  • CID 165854932