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Home > Pyridines > 832735-39-4
832735-39-4 | [3,3'-Bipyridin]-6(1H)-one, 6'-[(1-cyclobutyl-4-piperidinyl)oxy]-1-ethyl-
CAS No: 832735-39-4 Catalog No: AG004TAY MDL No:
Product Description
Catalog Number:
AG004TAY
Chemical Name:
[3,3'-Bipyridin]-6(1H)-one, 6'-[(1-cyclobutyl-4-piperidinyl)oxy]-1-ethyl-
CAS Number:
832735-39-4
Molecular Formula:
C21H27N3O2
Molecular Weight:
353.4580
IUPAC Name:
5-[6-(1-cyclobutylpiperidin-4-yl)oxypyridin-3-yl]-1-ethylpyridin-2-one
InChI:
InChI=1S/C21H27N3O2/c1-2-23-15-17(7-9-21(23)25)16-6-8-20(22-14-16)26-19-10-12-24(13-11-19)18-4-3-5-18/h6-9,14-15,18-19H,2-5,10-13H2,1H3
InChI Key:
UJPAEBDXXUDTBS-UHFFFAOYSA-N
SMILES:
CCn1cc(ccc1=O)c1ccc(nc1)OC1CCN(CC1)C1CCC1
Properties
Complexity:
562
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.21g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
353.466g/mol
Monoisotopic Mass:
353.21g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
45.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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