AG007JDQ

15264-63-8 | 1,3,4-Oxadiazole-2(3H)-thione,5-(4-pyridinyl)-

AG007JDQ

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CAS Number	15264-63-8
Catalog Number	AG007JDQ(AGN-PC-0JW8BI)
Chemical Name	1,3,4-Oxadiazole-2(3H)-thione,5-(4-pyridinyl)-
IUPAC Name	5-pyridin-4-yl-3H-1,3,4-oxadiazole-2-thione
InChI	InChI=1S/C7H5N3OS/c12-7-10-9-6(11-7)5-1-3-8-4-2-5/h1-4H,(H,10,12)
InChI Key	TXCXZVFDWQYTIC-UHFFFAOYSA-N
MDL Number	MFCD00215200
Molecular Formula	C7H5N3OS
Molecular Weight	179.1991
SMILES	SC1=NN=C(C2=CC=NC=C2)O1
Synonyms	15264-63-8, 5-(4-Pyridyl)-1,3,4-oxadiazole-2-thiol, 5-(pyridin-4-yl)-1,3,4-oxadiazole-2-thiol, 5-pyridin-4-yl-[1,3,4]oxadiazole-2-thiol, 5-(pyridin-4-yl)-1,3,4-oxadiazole-2(3H)-thione, CHEMBL571513, 5-pyridin-4-yl-1,3,4-oxadiazole-2-thiol, 5-(4-pyridinyl)-1,3,4-oxadiazole-2-thiol, TXCXZVFDWQYTIC-UHFFFAOYSA-N, 1,3,4-Oxadiazole-2(3H)-thione,5-(4-pyridinyl)-, MFCD00215200, 1,3,4-Oxadiazole-2-thiol, 5-(4-pyridinyl)-, 5-pyridin-4-yl-3H-1,3,4-oxadiazole-2-thione, ZERO/005315, AC1LGNJA, ChemDiv2_000174, AC1Q7F3J, Oprea1_290121, Oprea1_812023, SCHEMBL987340, SCHEMBL17065364, CTK4C7526, DTXSID90354468, HMS1369H20, ZINC345190, ACT08211, ALBB-012678, KS-00001QH5, 4742AD, BBL028396, BDBM50320728, SBB013324, STK074674, STL363760, TOD101310, AKOS000368634, AKOS001043797, ZINC521395906, MCULE-7331912073, AN-24879, AB0157726, ST4119458, TC-010603, 5-(4-pyridyl)-1,3,4-oxadiazole-2-thione, FT-0683624, 2-mercapto-5-(4-pyridyl)-1,3,4-oxadiazole, L-5310, 5-(4-pyridyl)-3H-1,3,4-oxadiazole-2-thione, 10E-063, 5-[4-Pyridyl]-1,3,4-oxadiazole-2(3H)-thione, 5-pyridin-4-yl-1,3,4-oxadiazole-2(3H)-thione, AF-615/00099028, 5-(4-pyridinyl)-1,3,4-oxadiazole-2(3H)-thione, 5-(4-Pyridyl)-1,3,4-oxadiazole-2-thiol, 97%, I09-2874, J-008943, F0300-0187, F1145-0002, F2135-0161, 5-(pyridin-4-yl)-2,3-dihydro-1,3,4-oxadiazole-2-thione, InChI=1/C7H5N3OS/c12-7-10-9-6(11-7)5-1-3-8-4-2-5/h1-4H,(H,10,12, D04QYN, C7H5N3OS, AR-1G5709, CID774383, 5-mercapto-2-(pyridin-4-yl)-1,3,4-oxadiazole, 1530-62-7,

Complexity	223
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.015g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	179.197g/mol
Monoisotopic Mass	179.015g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	78.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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