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Home > Aldehydes > 874945-93-4
874945-93-4 | Benzo[b]thiophene-3-carboxaldehyde, 2-(3-pyridinyl)-
CAS No: 874945-93-4 Catalog No: AG004I1L MDL No:
Product Description
Catalog Number:
AG004I1L
Chemical Name:
Benzo[b]thiophene-3-carboxaldehyde, 2-(3-pyridinyl)-
CAS Number:
874945-93-4
Molecular Formula:
C14H9NOS
Molecular Weight:
239.2924
IUPAC Name:
2-pyridin-3-yl-1-benzothiophene-3-carbaldehyde
InChI:
InChI=1S/C14H9NOS/c16-9-12-11-5-1-2-6-13(11)17-14(12)10-4-3-7-15-8-10/h1-9H
InChI Key:
GEJKTQGUQWJEAB-UHFFFAOYSA-N
SMILES:
O=Cc1c(sc2c1cccc2)c1cccnc1
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.04g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.292g/mol
Monoisotopic Mass:
239.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Synthesis and evaluation of benzo[b]thiophene derivatives as inhibitors of alkaline phosphatases. | Bioorganic & medicinal chemistry 20091015 |
| Synthesis and evaluation of new arylbenzo[b]thiophene and diarylthiophene derivatives as inhibitors of the NorA multidrug transporter of Staphylococcus aureus. | Bioorganic & medicinal chemistry 20070701 |
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