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80221-76-7 | Ethanone,1-(6-methyl-2-phenyl-4-quinolinyl)-2-(4-piperidinyl)-
CAS No: 80221-76-7 Catalog No: AG005CA4 MDL No:
Product Description
Catalog Number:
AG005CA4
Chemical Name:
Ethanone,1-(6-methyl-2-phenyl-4-quinolinyl)-2-(4-piperidinyl)-
CAS Number:
80221-76-7
Molecular Formula:
C23H24N2O
Molecular Weight:
344.4495
IUPAC Name:
1-(6-methyl-2-phenylquinolin-4-yl)-2-piperidin-4-ylethanone
InChI:
InChI=1S/C23H24N2O/c1-16-7-8-21-19(13-16)20(23(26)14-17-9-11-24-12-10-17)15-22(25-21)18-5-3-2-4-6-18/h2-8,13,15,17,24H,9-12,14H2,1H3
InChI Key:
YMGAGSTYUIHUTH-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(cc(n2)c1ccccc1)C(=O)CC1CCNCC1
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.189g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.458g/mol
Monoisotopic Mass:
344.189g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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