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100097-96-9 | 1-Propanone, 3-(4-fluorophenyl)-1-phenyl-3-(6-quinolinylamino)-
CAS No: 100097-96-9 Catalog No: AG0000WG MDL No:
Product Description
Catalog Number:
AG0000WG
Chemical Name:
1-Propanone, 3-(4-fluorophenyl)-1-phenyl-3-(6-quinolinylamino)-
CAS Number:
100097-96-9
Molecular Formula:
C24H19FN2O
Molecular Weight:
370.4189
IUPAC Name:
3-(4-fluorophenyl)-1-phenyl-3-(quinolin-6-ylamino)propan-1-one
InChI:
InChI=1S/C24H19FN2O/c25-20-10-8-17(9-11-20)23(16-24(28)18-5-2-1-3-6-18)27-21-12-13-22-19(15-21)7-4-14-26-22/h1-15,23,27H,16H2
InChI Key:
FOMOASQJJDJECM-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(CC(=O)c1ccccc1)Nc1ccc2c(c1)cccn2
Properties
Complexity:
499
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.148g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
370.427g/mol
Monoisotopic Mass:
370.148g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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