5-Pyrimidinecarboxamide, N-((1-benzyl-2-pyrrolidinyl)methyl)-2-(dimeth ylamino)-4-methoxy-, dihydrochloride

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Names

[ Name ]:
5-Pyrimidinecarboxamide, N-((1-benzyl-2-pyrrolidinyl)methyl)-2-(dimeth ylamino)-4-methoxy-, dihydrochloride

[Synonym ]:
N-[(1-benzylpyrrolidin-2-yl)methyl]-2-(dimethylamino)-4-methoxypyrimidine-5-carboxamide dihydrochloride
5-Pyrimidinecarboxamide,N-((1-benzyl-2-pyrrolidinyl)methyl)-2-(dimethylamino)-4-methoxy-,dihydrochloride

Chemical & Physical Properties

[ Boiling Point ]:
603.7ºC at 760 mmHg

[ Molecular Formula ]:
C₂₀H₂₉Cl₂N₅O₂

[ Molecular Weight ]:
442.38300

[ Flash Point ]:
318.9ºC

[ Exact Mass ]:
441.17000

[ PSA ]:
74.08000

[ LogP ]:
4.06230

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UV7707200

CHEMICAL NAME :: 5-Pyrimidinecarboxamide, N-((1-benzyl-2-pyrrolidinyl)methyl)-2-(dimethylamino) -4-methoxy-, dihydrochloride

CAS REGISTRY NUMBER :: 84332-26-3

LAST UPDATED :: 198609

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C20-H27-N5-O2.2Cl-H

MOLECULAR WEIGHT :: 442.44

WISWESSER LINE NOTATION :: T6N CNJ BN1&1 DO1 EVM1- BT5NTJ A1R &GH 2

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 :: 115 mg/kg

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

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 17,437,1982

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

ethyl 4-chloro-2-(dimethylamino)pyrimidine-5-carboxylate
methyl 2-(dimethylamino)-4-methoxypyrimidine-5-carboxylate
ethyl 2-dimethylamino-4-oxo-3H-pyrimidine-5-carboxylate
Ethyl 4-hydroxy-2-methylthio-5-pyrimidinecarboxylate
(1-benzylpyrrolidin-2-yl)methanamine
2-(dimethylamino)-4-methoxy-5-pyrimidinyl carboxylic acid

DownStream

Related Compounds

(S)-tert-butyl 3-(N-methylthiophene-2-carboxamido)pyrrolidine-1-carboxylate
(S)-tert-butyl 3-(N-methyl-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamido)pyrrolidine-1-carboxylate
(S)-tert-butyl 3-(N-methylbenzo[d][1,3]dioxole-5-carboxamido)pyrrolidine-1-carboxylate
(S)-tert-butyl 3-(N-methylthiophene-3-carboxamido)pyrrolidine-1-carboxylate
(S)-tert-butyl 3-(N-methylpyrazine-2-carboxamido)pyrrolidine-1-carboxylate
(S)-tert-butyl 3-(N-methyl-2-(thiophen-3-yl)acetamido)pyrrolidine-1-carboxylate
(S)-tert-butyl 3-(methyl(3-nitropyridin-2-yl)amino)pyrrolidine-1-carboxylate
(S)-tert-butyl 3-(methyl(6-methylpyridazin-3-yl)amino)pyrrolidine-1-carboxylate
(S)-tert-butyl 3-((6-chloropyridazin-3-yl)(methyl)amino)pyrrolidine-1-carboxylate
(S)-tert-butyl 3-((6-bromopyridin-2-yl)(methyl)amino)pyrrolidine-1-carboxylate

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