3-Thiazolidinepropanamide, 2-((2-methoxyphenoxy)methyl)-beta-oxo-N-(4- pyridinylmethyl)-, hydrochloride, hydrate (1:1:1)

Modify Date: 2025-09-02 12:24:22

3-Thiazolidinepropanamide, 2-((2-methoxyphenoxy)methyl)-beta-oxo-N-(4- pyridinylmethyl)-, hydrochloride, hydrate (1:1:1) structure	Common Name	3-Thiazolidinepropanamide, 2-((2-methoxyphenoxy)methyl)-beta-oxo-N-(4- pyridinylmethyl)-, hydrochloride, hydrate (1:1:1)
	CAS Number	161364-77-8	Molecular Weight	437.94000
	Density	N/A	Boiling Point	689.7ºC at 760mmHg
	Molecular Formula	C₂₀H₂₄ClN₃O₄S	Melting Point	N/A
	MSDS	N/A	Flash Point	370.9ºC

Name	3-[2-[(2-methoxyphenoxy)methyl]-1,3-thiazolidin-3-yl]-3-oxo-N-(pyridin-4-ylmethyl)propanamide,hydrochloride

Boiling Point	689.7ºC at 760mmHg
Molecular Formula	C₂₀H₂₄ClN₃O₄S
Molecular Weight	437.94000
Flash Point	370.9ºC
Exact Mass	437.11800
PSA	109.55000
LogP	3.65720
Vapour Pressure	7.12E-19mmHg at 25°C
InChIKey	PQPMFHMNCUFVJV-UHFFFAOYSA-N
SMILES	COc1ccccc1OCC1SCCN1C(=O)CC(=O)NCc1ccncc1.Cl

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XJ6094034

CAS REGISTRY NUMBER :: 161364-77-8

LAST UPDATED :: 199603

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C20-H23-N3-O4-S.Cl-H.H2-O

MOLECULAR WEIGHT :: 456.00

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 :: 707 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: 38,508,1995

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