Home Carboxys methyl 3-amino-5-(pyridin-4-yl)thiophene-2-carboxylate

methyl 3-amino-5-(pyridin-4-yl)thiophene-2-carboxylate

CAS No.:
887247-25-8
Catalog Number:
AG01C5T1
Molecular Formula:
C11H10N2O2S
Molecular Weight:
234.2743
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Product Description
Catalog Number:
AG01C5T1
Chemical Name:
methyl 3-amino-5-(pyridin-4-yl)thiophene-2-carboxylate
CAS Number:
887247-25-8
Molecular Formula:
C11H10N2O2S
Molecular Weight:
234.2743
MDL Number:
MFCD11104882
IUPAC Name:
methyl 3-amino-5-pyridin-4-ylthiophene-2-carboxylate
InChI:
InChI=1S/C11H10N2O2S/c1-15-11(14)10-8(12)6-9(16-10)7-2-4-13-5-3-7/h2-6H,12H2,1H3
InChI Key:
MTWPBJBUARILTH-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc(cc1N)c1ccncc1
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.046g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.273g/mol
Monoisotopic Mass:
234.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties