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AG019JAZ

Name: 3-(2-Furylmethyl)-2-mercaptoquinazolin-4(3h)-one
Brand: Angene Chemical
SKU: AG019JAZ

333785-55-0 | 3-(2-Furylmethyl)-2-mercaptoquinazolin-4(3h)-one

Chemical structure of 3-(2-Furylmethyl)-2-mercaptoquinazolin-4(3h)-one, CAS 333785-55-0

AG019JAZ

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CAS Number	333785-55-0
Catalog Number	AG019JAZ(AGN-PC-0WBA37)
Chemical Name	3-(2-Furylmethyl)-2-mercaptoquinazolin-4(3h)-one
IUPAC Name	3-(furan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one
InChI	InChI=1S/C13H10N2O2S/c16-12-10-5-1-2-6-11(10)14-13(18)15(12)8-9-4-3-7-17-9/h1-7H,8H2,(H,14,18)
InChI Key	DZUDSAYOEVFSAS-UHFFFAOYSA-N
MDL Number	MFCD00124170
Molecular Formula	C13H10N2O2S
Molecular Weight	258.2957
SMILES	O=C1N(CC2=CC=CO2)C(S)=NC3=C1C=CC=C3
Synonyms	333785-55-0, 3-(2-furylmethyl)-2-mercaptoquinazolin-4(3H)-one, 3-Furan-2-ylmethyl-2-mercapto-3H-quinazolin-4-one, 3-(furan-2-ylmethyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one, 3-(furan-2-ylmethyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one, 3-(Furan-2-ylmethyl)-2-mercaptoquinazolin-4(3H)-one, 3-(2-furylmethyl)-2-sulfanyl-3-hydroquinazolin-4-one, AC1LFDL4, AC1Q7GD5, Oprea1_180476, Oprea1_652703, ZINC316464, BBL000464, HTS015044, MFCD02650889, SBB007111, STK261359, STK349634, AKOS000310338, AKOS001058646, MCULE-5531784187, NE21250, BAS 02914547, EU-0094342, ST45075803, T9516, EN300-09011, AB00116712-01, SR-01000556684, SR-01000556684-1, 3-(furan-2-ylmethyl)-2-sulfanylquinazolin-4(3H)-one, Z55992920, F6609-8314, 3-(furan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one, 3-(2-furylmethyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone, 3-(2-furylmethyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one, 3-[(furan-2-yl)methyl]-2,3-dihydro-2-thioxoquinazolin-4(1h)-one, 3-[(furan-2-yl)methyl]-2-sulfanyl-3,4-dihydroquinazolin-4-one, 3-[(furan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one, C13H10N2O2S, CID801286, ZINC00308464,

Complexity	361
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	258.046g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	258.295g/mol
Monoisotopic Mass	258.046g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	77.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited