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Ethyl 2-amino-4-(5-methyl-2-thienyl)thiophene-3-carboxylate

CAS No.:
379247-26-4
Catalog Number:
AG00I7GP
Molecular Formula:
C12H13NO2S2
Molecular Weight:
267.3671
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Product Description
Catalog Number:
AG00I7GP
Chemical Name:
Ethyl 2-amino-4-(5-methyl-2-thienyl)thiophene-3-carboxylate
CAS Number:
379247-26-4
Molecular Formula:
C12H13NO2S2
Molecular Weight:
267.3671
MDL Number:
MFCD03028437
IUPAC Name:
ethyl 2-amino-4-(5-methylthiophen-2-yl)thiophene-3-carboxylate
InChI:
InChI=1S/C12H13NO2S2/c1-3-15-12(14)10-8(6-16-11(10)13)9-5-4-7(2)17-9/h4-6H,3,13H2,1-2H3
InChI Key:
OCXFDSDTIGSDOV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(N)scc1c1ccc(s1)C
Properties
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.039g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
267.361g/mol
Monoisotopic Mass:
267.039g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties