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51135-38-7 | 7-Benzoylindolin-2-one
CAS No: 51135-38-7 Catalog No: AG003ND9 MDL No:MFCD07784039
Product Description
Catalog Number:
AG003ND9
Chemical Name:
7-Benzoylindolin-2-one
CAS Number:
51135-38-7
Molecular Formula:
C15H11NO2
Molecular Weight:
237.2533
MDL Number:
MFCD07784039
IUPAC Name:
7-benzoyl-1,3-dihydroindol-2-one
InChI:
InChI=1S/C15H11NO2/c17-13-9-11-7-4-8-12(14(11)16-13)15(18)10-5-2-1-3-6-10/h1-8H,9H2,(H,16,17)
InChI Key:
APGQYYFHBPQPTL-UHFFFAOYSA-N
SMILES:
O=C1Cc2c(N1)c(ccc2)C(=O)c1ccccc1
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.258g/mol
Monoisotopic Mass:
237.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Antiinflammatory agents. 1. Synthesis and antiinflammatory activity of 2-amino-3-benzoylphenylacetic acid. | Journal of medicinal chemistry 19790901 |
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