1,3,4-Oxadiazole-2(3H)-thione, 3-(((3,5-dimethylphenyl)amino)methyl)-5-(4-pyridinyl)-

Modify Date: 2024-01-04 12:52:35

1,3,4-Oxadiazole-2(3H)-thione, 3-(((3,5-dimethylphenyl)amino)methyl)-5-(4-pyridinyl)- structure	Common Name	1,3,4-Oxadiazole-2(3H)-thione, 3-(((3,5-dimethylphenyl)amino)methyl)-5-(4-pyridinyl)-
	CAS Number	84249-79-6	Molecular Weight	312.38900
	Density	1.28g/cm3	Boiling Point	475.7ºC at 760 mmHg
	Molecular Formula	C₁₆H₁₆N₄OS	Melting Point	N/A
	MSDS	N/A	Flash Point	241.5ºC

Name	3-[(3,5-dimethylanilino)methyl]-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione

Density	1.28g/cm3
Boiling Point	475.7ºC at 760 mmHg
Molecular Formula	C₁₆H₁₆N₄OS
Molecular Weight	312.38900
Flash Point	241.5ºC
Exact Mass	312.10400
PSA	87.97000
LogP	4.02700
Index of Refraction	1.663
InChIKey	KJGSZBKTBZHZCO-UHFFFAOYSA-N
SMILES	Cc1cc(C)cc(NCn2nc(-c3ccncc3)oc2=S)c1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: RO0833250

CHEMICAL NAME :: 1,3,4-Oxadiazole-2(3H)-thione, 3-(((3,5-dimethylphenyl)amino)methyl)-5-(4-pyridinyl) -

CAS REGISTRY NUMBER :: 84249-79-6

LAST UPDATED :: 199207

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C16-H16-N4-O-S

MOLECULAR WEIGHT :: 312.42

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 :: >1 gm/kg

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

REFERENCE :: IJPPAZ Indian Journal of Physiology and Pharmacology. (All India Institute of Medical Sciences, Dept. of Physiology, Ansari Nagar, New Delhi 110 029, India) V.1- 1957- Volume(issue)/page/year: 26,113,1982

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