Home Halogens 7-(4-chlorobutoxy)-1-{4-[(2-oxo-1,2-dihydroquinolin-7-yl)oxy]butyl}-1,2-dihydroquinolin-2-one

7-(4-chlorobutoxy)-1-{4-[(2-oxo-1,2-dihydroquinolin-7-yl)oxy]butyl}-1,2-dihydroquinolin-2-one

CAS No.:
2060029-80-1
Catalog Number:
AG01C0GX
Molecular Formula:
C26H27ClN2O4
Molecular Weight:
466.9566
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Product Description
Catalog Number:
AG01C0GX
Chemical Name:
7-(4-chlorobutoxy)-1-{4-[(2-oxo-1,2-dihydroquinolin-7-yl)oxy]butyl}-1,2-dihydroquinolin-2-one
CAS Number:
2060029-80-1
Molecular Formula:
C26H27ClN2O4
Molecular Weight:
466.9566
MDL Number:
MFCD30498001
IUPAC Name:
7-(4-chlorobutoxy)-1-[4-[(2-oxo-1H-quinolin-7-yl)oxy]butyl]quinolin-2-one
InChI:
InChI=1S/C26H27ClN2O4/c27-13-1-3-15-33-22-10-6-20-8-12-26(31)29(24(20)18-22)14-2-4-16-32-21-9-5-19-7-11-25(30)28-23(19)17-21/h5-12,17-18H,1-4,13-16H2,(H,28,30)
InChI Key:
WBJYQGGOMQBPCL-UHFFFAOYSA-N
SMILES:
ClCCCCOc1ccc2c(c1)n(CCCCOc1ccc3c(c1)[nH]c(=O)cc3)c(=O)cc2
Properties
Complexity:
727  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
466.166g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
466.962g/mol
Monoisotopic Mass:
466.166g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties