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Home > Indoles and Oxindole > 150810-71-2
150810-71-2 | 1,2-Naphthalenedione, 4-(1H-indol-3-yl)-
CAS No: 150810-71-2 Catalog No: AG001MVX MDL No:
Product Description
Catalog Number:
AG001MVX
Chemical Name:
1,2-Naphthalenedione, 4-(1H-indol-3-yl)-
CAS Number:
150810-71-2
Molecular Formula:
C18H11NO2
Molecular Weight:
273.2854
IUPAC Name:
4-(1H-indol-3-yl)naphthalene-1,2-dione
InChI:
InChI=1S/C18H11NO2/c20-17-9-14(11-5-1-2-7-13(11)18(17)21)15-10-19-16-8-4-3-6-12(15)16/h1-10,19H
InChI Key:
JGGZODMUNMPWQU-UHFFFAOYSA-N
SMILES:
O=C1C(=O)C=C(c2c1cccc2)c1c[nH]c2c1cccc2
Properties
Complexity:
495
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.079g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.291g/mol
Monoisotopic Mass:
273.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| Synthesis and PTP1B inhibition of 1,2-naphthoquinone derivatives as potent anti-diabetic agents. | Bioorganic & medicinal chemistry letters 20020805 |
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