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261-01-8 | Pyrimido[4,5-b]quinoline
CAS No: 261-01-8 Catalog No: AG002RO2 MDL No:
Product Description
Catalog Number:
AG002RO2
Chemical Name:
Pyrimido[4,5-b]quinoline
CAS Number:
261-01-8
Molecular Formula:
C11H7N3
Molecular Weight:
181.1934
IUPAC Name:
pyrimido[4,5-b]quinoline
InChI:
InChI=1S/C11H7N3/c1-2-4-10-8(3-1)5-9-6-12-7-13-11(9)14-10/h1-7H
InChI Key:
LTIAEPYUMKCFJZ-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)nc1c(c2)cncn1
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.198g/mol
Monoisotopic Mass:
181.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| In vitro anticancer screening and radiosensitizing evaluation of some new quinolines and pyrimido[4,5-b]quinolines bearing a sulfonamide moiety. | European journal of medicinal chemistry 20100901 |
| Synthesis and docking studies of some novel quinoline derivatives bearing a sulfonamide moiety as possible anticancer agents. | Arzneimittel-Forschung 20100101 |
| Design, synthesis and anticancer evaluation of novel tetrahydroquinoline derivatives containing sulfonamide moiety. | European journal of medicinal chemistry 20091001 |
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