68771-50-6

68771-50-6 structure

68771-50-6 structure

Name: 4-methylbenzenesulfonate,N-(1-methylquinolin-1-ium-6-yl)-2-[4-[2-[(1-methylquinolin-1-ium-6-yl)amino]-2-oxoethyl]phenyl]acetamide
Chemical Name: 4-methylbenzenesulfonate,N-(1-methylquinolin-1-ium-6-yl)-2-[4-[2-[(1-methylquinolin-1-ium-6-yl)amino]-2-oxoethyl]phenyl]acetamide
CAS Number: 68771-50-6
Molecular Formula: C₄₄H₄₂N₄O₈S₂
Molecular Weight: 818.95600
Create Date: 2016-10-31 09:19:58
Modify Date: 2024-01-08 17:18:08

Name	4-methylbenzenesulfonate,N-(1-methylquinolin-1-ium-6-yl)-2-[4-[2-[(1-methylquinolin-1-ium-6-yl)amino]-2-oxoethyl]phenyl]acetamide
Synonyms	Quinolinium,6,6'-(p-phenylenebis(methylenecarbonylimino))bis(1-methyl-,di-p-toluenesulfonate N-(1-methylquinolin-1-ium-6-yl)-2-[4-[2-[(1-methylquinolin-1-ium-6-yl)amino]-2-oxoethyl]phenyl]acetamide 6,6'-(p-Phenylenebis(methylenecarbonylimino))bis(1-methylquinolinium) di-p-toluenesulfonate

Molecular Formula	C₄₄H₄₂N₄O₈S₂
Molecular Weight	818.95600
Exact Mass	818.24400
PSA	194.22000
LogP	8.65500

CHEMICAL IDENTIFICATION

RTECS NUMBER :: VC3968543

CHEMICAL NAME :: Quinolinium, 6,6'-(p-phenylenebis(methylenecarbonylimino))bis(1-me thyl-, di-p- toluenesulfonate

CAS REGISTRY NUMBER :: 68771-50-6

LAST UPDATED :: 199007

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C30-H28-N4-O2.2C7-H7-O3-S

MOLECULAR WEIGHT :: 819.02

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD10 - Lethal Dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 15 mg/kg

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

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: 22,134,1979