Home Carboxys Methyl 3-aminothieno[3,2-b]pyridine-2-carboxylate

Methyl 3-aminothieno[3,2-b]pyridine-2-carboxylate

CAS No.:
111042-90-1
Catalog Number:
AG007BKM
Molecular Formula:
C9H8N2O2S
Molecular Weight:
208.2370
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Product Description
Catalog Number:
AG007BKM
Chemical Name:
Methyl 3-aminothieno[3,2-b]pyridine-2-carboxylate
CAS Number:
111042-90-1
Molecular Formula:
C9H8N2O2S
Molecular Weight:
208.2370
MDL Number:
MFCD08448152
IUPAC Name:
methyl 3-aminothieno[3,2-b]pyridine-2-carboxylate
InChI:
InChI=1S/C9H8N2O2S/c1-13-9(12)8-6(10)7-5(14-8)3-2-4-11-7/h2-4H,10H2,1H3
InChI Key:
FFHLOZJKPAWEAX-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc2c(c1N)nccc2
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.031g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.235g/mol
Monoisotopic Mass:
208.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Aminodi(hetero)arylamines in the thieno[3,2-b]pyridine series: synthesis, effects in human tumor cells growth, cell cycle analysis, apoptosis and evaluation of toxicity using non-tumor cells. Molecules (Basel, Switzerland) 20120328
Properties