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Home Carboxys 2-Amino-5-dimethylcarbamoyl-4-methyl-thiophene-3-carboxylic acid ethyl ester

2-Amino-5-dimethylcarbamoyl-4-methyl-thiophene-3-carboxylic acid ethyl ester

CAS No.:
217962-82-8
Catalog Number:
AG00BDV6
Molecular Formula:
C11H16N2O3S
Molecular Weight:
256.3213
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Product Description
Catalog Number:
AG00BDV6
Chemical Name:
2-Amino-5-dimethylcarbamoyl-4-methyl-thiophene-3-carboxylic acid ethyl ester
CAS Number:
217962-82-8
Molecular Formula:
C11H16N2O3S
Molecular Weight:
256.3213
MDL Number:
MFCD01827721
IUPAC Name:
ethyl 2-amino-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
InChI:
InChI=1S/C11H16N2O3S/c1-5-16-11(15)7-6(2)8(17-9(7)12)10(14)13(3)4/h5,12H2,1-4H3
InChI Key:
VOFMVGKEJXTNCQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(N)sc(c1C)C(=O)N(C)C
NSC Number:
730217
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.088g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.32g/mol
Monoisotopic Mass:
256.088g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
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