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Home > Indoles and Oxindole > 1175965-80-6
1175965-80-6 | 1H-Indole-2,3-dione, 6-(phenylmethoxy)-
CAS No: 1175965-80-6 Catalog No: AG000HIJ MDL No:
Product Description
Catalog Number:
AG000HIJ
Chemical Name:
1H-Indole-2,3-dione, 6-(phenylmethoxy)-
CAS Number:
1175965-80-6
Molecular Formula:
C15H11NO3
Molecular Weight:
253.2527
IUPAC Name:
6-phenylmethoxy-1H-indole-2,3-dione
InChI:
InChI=1S/C15H11NO3/c17-14-12-7-6-11(8-13(12)16-15(14)18)19-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17,18)
InChI Key:
SJUHDYWILSOYEK-UHFFFAOYSA-N
SMILES:
O=C1C(=O)Nc2c1ccc(c2)OCc1ccccc1
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.074g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.257g/mol
Monoisotopic Mass:
253.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Inhibition of monoamine oxidase by selected C5- and C6-substituted isatin analogues. | Bioorganic & medicinal chemistry 20110101 |
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