4-amino-N-(1-cyclohexylpyrrolidin-1-ium-3-yl)-N-methylbenzamide,(E)-4-hydroxy-4-oxobut-2-enoate

Names

[ Name ]:
4-amino-N-(1-cyclohexylpyrrolidin-1-ium-3-yl)-N-methylbenzamide,(E)-4-hydroxy-4-oxobut-2-enoate

[Synonym ]:
p-Amino-N-(1-cyclohexyl-3-pyrrolidinyl)-N-methylbenzamide fumarate
AHR-5645 B
Fumarate d'amino-4 N-(cyclohexyl-1-pyrrolidinyl-3) N-methyl benzamide
4-Amino-N-(1-cyclohexyl-3-pyrrolidinyl)-N-methylbenzamide fumarate
BENZAMIDE,p-AMINO-N-(1-CYCLOHEXYL-3-PYRROLIDINYL)-N-METHYL-,FUMARATE
4-amino-N-(1-cyclohexylpyrrolidin-1-ium-3-yl)-N-methylbenzamide

Chemical & Physical Properties

[ Molecular Formula ]:
C₂₂H₃₁N₃O₅

[ Molecular Weight ]:
417.49900

[ Exact Mass ]:
417.22600

[ PSA ]:
124.17000

[ LogP ]:
2.97870

[ Vapour Pressure ]:
8.47E-10mmHg at 25°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CU9460000

CHEMICAL NAME :: Benzamide, p-amino-N-(1-cyclohexyl-3-pyrrolidinyl)-N-methyl-, fumarate

CAS REGISTRY NUMBER :: 102585-97-7

LAST UPDATED :: 199109

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C18-H27-N3-O.C4-H4-O4

MOLECULAR WEIGHT :: 417.56

WISWESSER LINE NOTATION :: T5NTJ CN1&VR DZ& A- AL6TJ &QV1U1VQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 450 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 32,121,1977

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 208 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 32,121,1977

Related Compounds

tert-butyl N-{5-hydroxy-8-methyl-[1,2,4]triazolo[4,3-c]pyrimidin-3-yl}carbamate
tert-butyl N-[(5-hydroxy-1,3-dimethyl-1H-pyrazol-4-yl)methyl]carbamate
tert-butyl N-(3-bromo-6-hydroxy-2-methylphenyl)carbamate
tert-butyl N-(4-fluoro-3-hydroxy-2-methylphenyl)carbamate
tert-butyl N-(3-hydroxy-2,4,6-trimethylphenyl)carbamate
5-{[(Tert-butoxy)carbonyl](4,6-dimethylpyrimidin-2-yl)amino}-2-hydroxybenzoic acid
tert-butyl N-(3-chloro-6-fluoro-2-hydroxy-5-methylphenyl)carbamate
tert-butyl N-(2,5-difluoro-6-hydroxy-3-methylphenyl)carbamate
tert-butyl N-(3-chloro-2-fluoro-6-hydroxyphenyl)carbamate
tert-butyl N-[1-hydroxy-3-(propan-2-yloxy)propan-2-yl]-N-methylcarbamate

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