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Home > Quinoline > 128532-89-8
128532-89-8 | Pentanediamide, N1,N5-bis(2-methyl-8-quinolinyl)-
CAS No: 128532-89-8 Catalog No: AG000Y6D MDL No:
Product Description
Catalog Number:
AG000Y6D
Chemical Name:
Pentanediamide, N1,N5-bis(2-methyl-8-quinolinyl)-
CAS Number:
128532-89-8
Molecular Formula:
C25H24N4O2
Molecular Weight:
412.4837
IUPAC Name:
N,N'-bis(2-methylquinolin-8-yl)pentanediamide
InChI:
InChI=1S/C25H24N4O2/c1-16-12-14-18-6-3-8-20(24(18)26-16)28-22(30)10-5-11-23(31)29-21-9-4-7-19-15-13-17(2)27-25(19)21/h3-4,6-9,12-15H,5,10-11H2,1-2H3,(H,28,30)(H,29,31)
InChI Key:
IMDYHTAICYEMIS-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc2c1nc(C)cc2)CCCC(=O)Nc1cccc2c1nc(C)cc2
Properties
Complexity:
575
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
412.19g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
412.493g/mol
Monoisotopic Mass:
412.19g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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