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Home > Quinoline > 478064-94-7
478064-94-7 | 3-{[1,1'-biphenyl]-4-carbonyl}-4-methylquinoline
CAS No: 478064-94-7 Catalog No: AG00IYLW MDL No:MFCD02570843
Product Description
Catalog Number:
AG00IYLW
Chemical Name:
3-{[1,1'-biphenyl]-4-carbonyl}-4-methylquinoline
CAS Number:
478064-94-7
Molecular Formula:
C23H17NO
Molecular Weight:
323.3872
MDL Number:
MFCD02570843
IUPAC Name:
(4-methylquinolin-3-yl)-(4-phenylphenyl)methanone
InChI:
InChI=1S/C23H17NO/c1-16-20-9-5-6-10-22(20)24-15-21(16)23(25)19-13-11-18(12-14-19)17-7-3-2-4-8-17/h2-15H,1H3
InChI Key:
GHMZCUXABOIUMB-UHFFFAOYSA-N
SMILES:
O=C(c1cnc2c(c1C)cccc2)c1ccc(cc1)c1ccccc1
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.131g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.395g/mol
Monoisotopic Mass:
323.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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