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Home > Fluorides > 146824-88-6
146824-88-6 | 4(1H)-Pyridazinone, 1-(4-fluorophenyl)-6-methyl-3-(2-quinolinylmethoxy)-
CAS No: 146824-88-6 Catalog No: AG001EDB MDL No:
Product Description
Catalog Number:
AG001EDB
Chemical Name:
4(1H)-Pyridazinone, 1-(4-fluorophenyl)-6-methyl-3-(2-quinolinylmethoxy)-
CAS Number:
146824-88-6
Molecular Formula:
C21H16FN3O2
Molecular Weight:
361.3690
IUPAC Name:
1-(4-fluorophenyl)-6-methyl-3-(quinolin-2-ylmethoxy)pyridazin-4-one
InChI:
InChI=1S/C21H16FN3O2/c1-14-12-20(26)21(24-25(14)18-10-7-16(22)8-11-18)27-13-17-9-6-15-4-2-3-5-19(15)23-17/h2-12H,13H2,1H3
InChI Key:
JIYCLWVPZDMGIB-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)n1nc(OCc2ccc3c(n2)cccc3)c(=O)cc1C
Properties
Complexity:
613
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.123g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.376g/mol
Monoisotopic Mass:
361.123g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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