butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate

Modify Date: 2025-09-04 11:11:56

butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate Structure
butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate structure
 Common Name butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate
CAS Number 84496-19-5 Molecular Weight 573.08200
Density 1.29g/cm3 Boiling Point N/A
Molecular Formula C32H33ClN4O4 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate

 Chemical & Physical Properties

Density 1.29g/cm3
Molecular Formula C32H33ClN4O4
Molecular Weight 573.08200
Exact Mass 572.21900
PSA 94.80000
LogP 6.84690
Index of Refraction 1.642
InChIKey VKHQGBMGZPCAEN-UHFFFAOYSA-N
SMILES CCCCOC(=O)c1ccc(NC(=O)c2ccc(N=C3C(=O)N(CN4CCCCC4)c4ccc(Cl)cc43)cc2)cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DG4995770
CHEMICAL NAME :
Benzoic acid, 4-((4-((5-chloro-1,2-dihydro-2-oxo-1-(1-piperidinylme thyl)-3H-indol-3-ylid ene) amino)benzoyl)amino)-, butyl ester
CAS REGISTRY NUMBER :
84496-19-5
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C32-H33-Cl-N4-O4
MOLECULAR WEIGHT :
573.14

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) Behavioral - muscle contraction or spasticity Lungs, Thorax, or Respiration - respiratory depression
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

butamben structure

butamben

CAS#:94-25-7

~%

butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate Structure

butyl 4-[[4-[[5...

CAS#:84496-19-5

Literature: Verma, Rajendra S.; Pandey, Rajnish K.; Kumar, Piyush Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, p. 775 - 777
5-Chloroindoline-2,3-dione structure

5-Chloroindolin...

CAS#:17630-76-1

~%

butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate Structure

butyl 4-[[4-[[5...

CAS#:84496-19-5

Literature: Verma, Rajendra S.; Pandey, Rajnish K.; Kumar, Piyush Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, p. 775 - 777
4-Nitrobenzoyl chloride structure

4-Nitrobenzoyl ...

CAS#:122-04-3

~%

butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate Structure

butyl 4-[[4-[[5...

CAS#:84496-19-5

Literature: Verma, Rajendra S.; Pandey, Rajnish K.; Kumar, Piyush Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, p. 775 - 777
butyl 4-[(4'-aminobenzoyl)amino]benzoate structure

butyl 4-[(4'-am...

CAS#:84496-22-0

~%

butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate Structure

butyl 4-[[4-[[5...

CAS#:84496-19-5

Literature: Verma, Rajendra S.; Pandey, Rajnish K.; Kumar, Piyush Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, p. 775 - 777
butyl 4-[(4-nitrobenzoyl)amino]benzoate structure

butyl 4-[(4-nit...

CAS#:42421-51-2

~%

butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate Structure

butyl 4-[[4-[[5...

CAS#:84496-19-5

Literature: Verma, Rajendra S.; Pandey, Rajnish K.; Kumar, Piyush Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, p. 775 - 777
Piperidine structure

Piperidine

CAS#:110-89-4

Formaldehyde structure

Formaldehyde

CAS#:50-00-0

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

butyl 4-[[4-[(5...

CAS#:84496-08-2

~55%

butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate Structure

butyl 4-[[4-[[5...

CAS#:84496-19-5

Literature: Verma, Rajendra S.; Pandey, Rajnish K.; Kumar, Piyush Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, p. 775 - 777
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Chemsrc provides CAS#:84496-19-5 MSDS, density, melting point, boiling point, structure, etc. Its name is butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate>> amp version: butyl 4-[[4-[[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]benzoyl]amino]benzoate

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