1-tert-butyl-4a,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]benzimidazole,hydrochloride

Names

[ Name ]:
1-tert-butyl-4a,5,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]benzimidazole,hydrochloride

[Synonym ]:
Thiazolo(3,2-a)benzimidazole,4a,5,6,7,8,8a-hexahydro-3-(1,1-dimethylethyl)-,HCl,trans
trans-3-(tert-Butyl)-4a,5,6,7,8,8a-hexahydrothiazolo(3,2-a)benzimidazole hydrochloride
Thiazolo(3,2-a)benzimidazole,4a,5,6,7,8,8a-hexahydro-3-(tert-butyl)-,hydrochloride,(E)

Chemical & Physical Properties

[ Molecular Formula ]:
C₁₃H₂₁ClN₂S

[ Molecular Weight ]:
272.83700

[ Exact Mass ]:
272.11100

[ PSA ]:
45.53000

[ LogP ]:
3.48270

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XJ7050350

CHEMICAL NAME :: Thiazolo(3,2-a)benzimidazole, 4a,5,6,7,8,8a-hexahydro-3-(tert-butyl)-, hydrochloride, (E)-

CAS REGISTRY NUMBER :: 102612-96-4

LAST UPDATED :: 199706

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C13-H20-N2-S.Cl-H

MOLECULAR WEIGHT :: 272.87

WISWESSER LINE NOTATION :: T B556 BN ES GN FU&TTJ CX1&1&1 &GH

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 :: 20 mg/kg

TOXIC EFFECTS :: Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 24,604,1981

Related Compounds

(6-Fluoro-4-((1-(4-fluorophenyl)ethyl)amino)quinolin-3-yl)(pyrrolidin-1-yl)methanone
(4-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-6-fluoroquinolin-3-yl)(pyrrolidin-1-yl)methanone
(6-Fluoro-4-((2-(thiophen-2-yl)ethyl)amino)quinolin-3-yl)(pyrrolidin-1-yl)methanone
(6-Fluoro-4-((2-methylbenzyl)amino)quinolin-3-yl)(pyrrolidin-1-yl)methanone
(6-Fluoro-4-((1-(4-methoxyphenyl)ethyl)amino)quinolin-3-yl)(pyrrolidin-1-yl)methanone
(4-((3-Ethoxy-4-methoxybenzyl)amino)-6-fluoroquinolin-3-yl)(pyrrolidin-1-yl)methanone
{6-Chloro-4-[(2-methoxybenzyl)amino]quinolin-3-yl}(morpholin-4-yl)methanone
{6-Chloro-4-[(4-methoxybenzyl)amino]quinolin-3-yl}(morpholin-4-yl)methanone
{6-Chloro-4-[(2-ethoxybenzyl)amino]quinolin-3-yl}(morpholin-4-yl)methanone
6-chloro-N-[(4-ethoxyphenyl)methyl]-3-(morpholine-4-carbonyl)quinolin-4-amine