sodium 3-[[4-methyl-1-oxo-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperaz in-1-yl]pentan-2-yl]carbamoyl]oxirane-2-carboxylate

Modify Date: 2025-09-27 10:43:55

sodium 3-[[4-methyl-1-oxo-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperaz in-1-yl]pentan-2-yl]carbamoyl]oxirane-2-carboxylate structure	Common Name	sodium 3-[[4-methyl-1-oxo-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperaz in-1-yl]pentan-2-yl]carbamoyl]oxirane-2-carboxylate
	CAS Number	84456-41-7	Molecular Weight	515.53200
	Density	N/A	Boiling Point	710.7ºC at 760 mmHg
	Molecular Formula	C₂₄H₃₄N₃NaO₈	Melting Point	N/A
	MSDS	N/A	Flash Point	383.6ºC

Name	sodium,3-[[4-methyl-1-oxo-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]pentan-2-yl]carbamoyl]oxirane-2-carboxylate

Boiling Point	710.7ºC at 760 mmHg
Molecular Formula	C₂₄H₃₄N₃NaO₈
Molecular Weight	515.53200
Flash Point	383.6ºC
Exact Mass	515.22400
PSA	136.49000
LogP	1.32810
InChIKey	OZYMBTXBVRWWOX-UHFFFAOYSA-M
SMILES	COc1ccc(CN2CCN(C(=O)C(CC(C)C)NC(=O)C3OC3C(=O)[O-])CC2)c(OC)c1OC.[Na+]

CHEMICAL IDENTIFICATION

RTECS NUMBER :: RR0405749

CHEMICAL NAME :: Oxiranecarboxylic acid, 3-(((3-methyl-1-((4-((2,3,4-trimethoxyphenyl)methyl)- 1-piperazinyl) carbonyl)butyl)amino)carbonyl)-, monosodium salt

CAS REGISTRY NUMBER :: 84456-41-7

LAST UPDATED :: 199609

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C24-H34-N3-O8.Na

MOLECULAR WEIGHT :: 515.60

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD - Lethal dose

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >1125 mg/kg

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

REFERENCE :: USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4507297

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