Butanoic acid,1,1',1''-[(2R,3R,4R,5S)-1-butyl-2-[(1-oxobutoxy)methyl]-3,4,5-piperidinetriyl]ester

Names

[ Name ]:
Butanoic acid,1,1',1''-[(2R,3R,4R,5S)-1-butyl-2-[(1-oxobutoxy)methyl]-3,4,5-piperidinetriyl]ester

[Synonym ]:
Perbutylated-N-butyl-1-deoxynojiromycin
N-Butyl DNJ Prodrug
Glycovir
DRG-0193
Butanoic acid,1-butyl-2-((1-oxobutoxy)methyl)-3,4,5-piperidinetriyl ester,(2R-(2alpha,3beta,4alpha,5beta))

Chemical & Physical Properties

[ Density]:
1.09g/cm3

[ Boiling Point ]:
524ºC at 760mmHg

[ Molecular Formula ]:
C₂₆H₄₅NO₈

[ Molecular Weight ]:
499.63700

[ Flash Point ]:
270.7ºC

[ Exact Mass ]:
499.31500

[ PSA ]:
108.44000

[ LogP ]:
3.88760

[ Vapour Pressure ]:
4.48E-11mmHg at 25°C

[ Index of Refraction ]:
1.488

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: EK7713970

CHEMICAL NAME :: Butanoic acid, 1-butyl-2-((1-oxobutoxy)methyl)-3,4,5-piperidinetriyl ester, (2R-(2alpha,3beta,4alpha,5beta))-

CAS REGISTRY NUMBER :: 131262-82-3

LAST UPDATED :: 199801

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C26-H45-N-O8

MOLECULAR WEIGHT :: 499.72

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 103 gm/kg/4W-I

TOXIC EFFECTS :: Gastrointestinal - changes in structure or function of salivary glands Gastrointestinal - changes in structure or function of endocrine pancreas Gastrointestinal - other changes

REFERENCE :: TOPADD Toxicologic Pathology. (c/o Dr. F.A. de la Iglesia, Warner-Lambert Co., Pharmaceutical Research Div., POB 1047, Ann Arbor, MI 48106) V.6(3/4)- 1978- Volume(issue)/page/year: 24,531,1996

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 218 gm/kg/26W-I

TOXIC EFFECTS :: Gastrointestinal - changes in structure or function of endocrine pancreas Gastrointestinal - other changes Endocrine - other changes

REFERENCE :: TOPADD Toxicologic Pathology. (c/o Dr. F.A. de la Iglesia, Warner-Lambert Co., Pharmaceutical Research Div., POB 1047, Ann Arbor, MI 48106) V.6(3/4)- 1978- Volume(issue)/page/year: 24,531,1996

Related Compounds

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