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Ethyl 4-methyl-2-(2-thienyl)-thiazole-5-carboxylate

Ethyl 4-methyl-2-(2-thienyl)-thiazole-5-carboxylate - CAS 56421-62-6

Catalog:	BB029355
Product Name:	Ethyl 4-methyl-2-(2-thienyl)-thiazole-5-carboxylate
CAS:	56421-62-6
Synonyms:	ethyl 4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carboxylate
Description:	Ethyl 4-methyl-2-(2-thienyl)-thiazole-5-carboxylate (CAS# 56421-62-6) is a useful research chemical.
Molecular Weight:	253.34
Molecular Formula:	C11H11NO2S2
Canonical SMILES:	CCOC(=O)C1=C(N=C(S1)C2=CC=CS2)C
InChI:	InChI=1S/C11H11NO2S2/c1-3-14-11(13)9-7(2)12-10(16-9)8-5-4-6-15-8/h4-6H,3H2,1-2H3
InChI Key:	NRTAQEAHFFIBFX-UHFFFAOYSA-N
Boiling Point:	380.9 °C at 760 mmHg
Density:	1.282 g/cm³
MDL:	MFCD00208019
LogP:	3.35670

Publication Number	Title	Priority Date
CN-107151243-B	2-substituted-4-methyl-5- (4, 5-dihydrothiazole-2-yl) -1, 3-thiazole compounds, preparation method and biological activity evaluation thereof	20161021
EP-2427447-A2	Small molecule inhibitors of influenza a and b virus and respiratory syncytial virus replication	20090508
WO-2010128163-A2	Small molecule inhibitors of influenza a and b virus and respiratory syncytial virus replication	20090508
CN-1242994-C	Novel heterocyclic compound and medicinal use thereof	20010529

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Complexity:	262
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	253.02312094
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	253.02312094
Rotatable Bond Count:	4
Topological Polar Surface Area:	95.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3