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20745-56-6 | 2-Propenamide, N-phenyl-3-(2-quinolinyl)-
CAS No: 20745-56-6 Catalog No: AG002J2S MDL No:
Product Description
Catalog Number:
AG002J2S
Chemical Name:
2-Propenamide, N-phenyl-3-(2-quinolinyl)-
CAS Number:
20745-56-6
Molecular Formula:
C18H14N2O
Molecular Weight:
274.3166
IUPAC Name:
N-phenyl-3-quinolin-2-ylprop-2-enamide
InChI:
InChI=1S/C18H14N2O/c21-18(20-15-7-2-1-3-8-15)13-12-16-11-10-14-6-4-5-9-17(14)19-16/h1-13H,(H,20,21)
InChI Key:
IJJVDSLTFQUTEJ-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1)C=Cc1ccc2c(n1)cccc2
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.111g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.323g/mol
Monoisotopic Mass:
274.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.5
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