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92119-01-2 | 4-Quinolinecarboxamide, N-phenyl-
CAS No: 92119-01-2 Catalog No: AG0066M2 MDL No:
Product Description
Catalog Number:
AG0066M2
Chemical Name:
4-Quinolinecarboxamide, N-phenyl-
CAS Number:
92119-01-2
Molecular Formula:
C16H12N2O
Molecular Weight:
248.2793
IUPAC Name:
N-phenylquinoline-4-carboxamide
InChI:
InChI=1S/C16H12N2O/c19-16(18-12-6-2-1-3-7-12)14-10-11-17-15-9-5-4-8-13(14)15/h1-11H,(H,18,19)
InChI Key:
WACMEQVZTAUIGH-UHFFFAOYSA-N
SMILES:
O=C(c1ccnc2c1cccc2)Nc1ccccc1
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.285g/mol
Monoisotopic Mass:
248.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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