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823832-57-1 | 4-Quinolinecarboxamide, 2-phenyl-N-[1-(4-pyridinyl)ethyl]-
CAS No: 823832-57-1 Catalog No: AG005C2H MDL No:
Product Description
Catalog Number:
AG005C2H
Chemical Name:
4-Quinolinecarboxamide, 2-phenyl-N-[1-(4-pyridinyl)ethyl]-
CAS Number:
823832-57-1
Molecular Formula:
C23H19N3O
Molecular Weight:
353.4165
IUPAC Name:
2-phenyl-N-(1-pyridin-4-ylethyl)quinoline-4-carboxamide
InChI:
InChI=1S/C23H19N3O/c1-16(17-11-13-24-14-12-17)25-23(27)20-15-22(18-7-3-2-4-8-18)26-21-10-6-5-9-19(20)21/h2-16H,1H3,(H,25,27)
InChI Key:
VMGCWHAPVRXEDB-UHFFFAOYSA-N
SMILES:
CC(c1ccncc1)NC(=O)c1cc(nc2c1cccc2)c1ccccc1
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.153g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
353.425g/mol
Monoisotopic Mass:
353.153g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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