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Home > Quinoline > 204459-33-6
204459-33-6 | [1,4]Benzodioxino[2,3-g]isoquinoline, 5,12-dimethyl-
CAS No: 204459-33-6 Catalog No: AG0029IO MDL No:
Product Description
Catalog Number:
AG0029IO
Chemical Name:
[1,4]Benzodioxino[2,3-g]isoquinoline, 5,12-dimethyl-
CAS Number:
204459-33-6
Molecular Formula:
C17H13NO2
Molecular Weight:
263.2906
IUPAC Name:
5,12-dimethyl-[1,4]benzodioxino[2,3-g]isoquinoline
InChI:
InChI=1S/C17H13NO2/c1-10-12-7-8-18-9-13(12)11(2)17-16(10)19-14-5-3-4-6-15(14)20-17/h3-9H,1-2H3
InChI Key:
GOLRTZAKBMGUEZ-UHFFFAOYSA-N
SMILES:
Cc1c2Oc3ccccc3Oc2c(c2c1cncc2)C
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.095g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.296g/mol
Monoisotopic Mass:
263.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Literature
| Title | Journal |
|---|---|
| Synthesis and structure-activity relationships of new benzodioxinic lactones as potential anticancer drugs. | Journal of medicinal chemistry 20070125 |
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