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Home > Aldehydes > 155819-08-2
155819-08-2 | 1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 1-(phenylsulfonyl)-
CAS No: 155819-08-2 Catalog No: AG001O8V MDL No:MFCD11616479
Product Description
Catalog Number:
AG001O8V
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 1-(phenylsulfonyl)-
CAS Number:
155819-08-2
Molecular Formula:
C14H10N2O3S
Molecular Weight:
286.3058
MDL Number:
MFCD11616479
IUPAC Name:
1-(benzenesulfonyl)pyrrolo[2,3-b]pyridine-3-carbaldehyde
InChI:
InChI=1S/C14H10N2O3S/c17-10-11-9-16(14-13(11)7-4-8-15-14)20(18,19)12-5-2-1-3-6-12/h1-10H
InChI Key:
WGSDEVIRNPPEQV-UHFFFAOYSA-N
SMILES:
O=Cc1cn(c2c1cccn2)S(=O)(=O)c1ccccc1
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.041g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.305g/mol
Monoisotopic Mass:
286.041g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Synthesis and antiproliferative activity of clausine E, mukonine, and koenoline bioisosteres. | Bioorganic & medicinal chemistry 20070815 |
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