N-[(E)-1-(4-chlorophenyl)ethylideneamino]-2-[4-[(Z)-(3-methyl-5-oxo-1H-pyrazol-4-ylidene)methyl]phenoxy]acetamide

Names

[ CAS No. ]:
107045-05-6

[ Name ]:
N-[(E)-1-(4-chlorophenyl)ethylideneamino]-2-[4-[(Z)-(3-methyl-5-oxo-1H-pyrazol-4-ylidene)methyl]phenoxy]acetamide

[Synonym ]:
Acetic acid,(4-((1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene)methyl)phenoxy)-,(1-(4-chlorophenyl)ethylidene)hydrazide

Chemical & Physical Properties

[ Density]:
1.315g/cm3

[ Molecular Formula ]:
C21H19ClN4O3

[ Molecular Weight ]:
410.85400

[ Exact Mass ]:
410.11500

[ PSA ]:
99.13000

[ LogP ]:
3.70010

[ Index of Refraction ]:
1.631

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AH0510000
CHEMICAL NAME :
Acetic acid, (4-((1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene) methyl)phenoxy)-, (1-(4-chlorophenyl)ethylidene)hydrazide
CAS REGISTRY NUMBER :
107045-05-6
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C21-H19-Cl-N4-O3
MOLECULAR WEIGHT :
410.89

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 :
Details of toxic effects not reported other than lethal dose value
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: 25,339,1986

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1-(4-Chlorophenyl)ethanone
  • 4-(3-Methyl-5-oxo-4-pyrazolidenemethyl)-phenoxyacetic acid hydrazide
  • ethyl (4-formylphenoxy)acetate
  • 4-hydroxybenzaldehyde
  • Ethyl 4-(3-methyl-5-oxo-pyrazolidenemethyl)-phenoxyacetate

DownStream

Related Compounds

  • 2-[[(3-Chlorophenyl)methylamino]methyl]aniline
  • N-(6-methyl-1,3-benzothiazol-2-yl)-3-(1H-tetrazol-1-yl)benzamide
  • N-(4-(5-chlorothiophen-2-yl)thiazol-2-yl)-2-(4-(ethylsulfonyl)phenyl)acetamide
  • (Z)-5-chloro-N-(3-propylbenzo[d]thiazol-2(3H)-ylidene)thiophene-2-carboxamide
  • 2-(3-((4-Fluorophenyl)sulfonyl)propanamido)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide hydrochloride
  • N-(1-propionyl-1,2,3,4-tetrahydroquinolin-7-yl)butyramide
  • Quercetin-3-neohesperidoside-7-rhamnoside
  • (2R)-2-[(2-amino-1,3-thiazol-4-yl)methyl]-N-[(2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-yl]-N'-[(1-methoxycyclohexyl)methyl]-N'-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]butanediamide
  • 1h-Indole-2-carboxamide,3-(phenylthio)-5-(1-piperidinylmethyl)-
  • 1-(4-Chlorophenyl)-N-(1-methyl-5-isoquinolinyl)-4-piperidinecarboxamide
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