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173208-51-0 | 2(1H)-Quinolinone, 4-hydroxy-3-[(4-methoxyphenyl)methyl]-1-methyl-
CAS No: 173208-51-0 Catalog No: AG001YPK MDL No:
Product Description
Catalog Number:
AG001YPK
Chemical Name:
2(1H)-Quinolinone, 4-hydroxy-3-[(4-methoxyphenyl)methyl]-1-methyl-
CAS Number:
173208-51-0
Molecular Formula:
C18H17NO3
Molecular Weight:
295.3325
IUPAC Name:
4-hydroxy-3-[(4-methoxyphenyl)methyl]-1-methylquinolin-2-one
InChI:
InChI=1S/C18H17NO3/c1-19-16-6-4-3-5-14(16)17(20)15(18(19)21)11-12-7-9-13(22-2)10-8-12/h3-10,20H,11H2,1-2H3
InChI Key:
JVWNNFWSNRDOCX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Cc1c(O)c2ccccc2n(c1=O)C
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.121g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.338g/mol
Monoisotopic Mass:
295.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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