Methyl 3-[(2-chlorophenyl)methoxy]thieno[2,3-b]pyridine-2-carboxylate

Base Information

• Chemical Name: Methyl 3-[(2-chlorophenyl)methoxy]thieno[2,3-b]pyridine-2-carboxylate
• CAS No.: 338419-37-7
• Molecular Formula: C16H12ClNO3S
• Molecular Weight: 333.8
• DSSTox Substance ID: DTXSID401156187
• ChEMBL ID: CHEMBL1574653
• Mol file: 338419-37-7.mol

Synonyms:338419-37-7;methyl 3-[(2-chlorophenyl)methoxy]thieno[2,3-b]pyridine-2-carboxylate;methyl 3-[(2-chlorobenzyl)oxy]thieno[2,3-b]pyridine-2-carboxylate;SMR000169332;MLS000543363;CHEMBL1574653;DTXSID401156187;HMS2425I05;AKOS005091177;4F-407S;SR-01000694531;SR-01000694531-2;methyl3-[(2-chlorophenyl)methoxy]thieno[2,3-b]pyridine-2-carboxylate

Chemical Property of Methyl 3-[(2-chlorophenyl)methoxy]thieno[2,3-b]pyridine-2-carboxylate

Chemical Property:

• PKA: 3.31±0.40(Predicted)
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 333.0226421
• Heavy Atom Count: 22
• Complexity: 398

Purity/Quality:

METHYL-3-[(2-CHLOROBENZYL)OXY]THIENO[2,3-B]PYRIDINE-2-CARBOXYLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=C(C2=C(S1)N=CC=C2)OCC3=CC=CC=C3Cl