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648896-10-0 | 2-Quinolinecarboxamide, 8-hydroxy-N-(2-pyridinylmethyl)-
CAS No: 648896-10-0 Catalog No: AG006RXP MDL No:
Product Description
Catalog Number:
AG006RXP
Chemical Name:
2-Quinolinecarboxamide, 8-hydroxy-N-(2-pyridinylmethyl)-
CAS Number:
648896-10-0
Molecular Formula:
C16H13N3O2
Molecular Weight:
279.2933
IUPAC Name:
8-hydroxy-N-(pyridin-2-ylmethyl)quinoline-2-carboxamide
InChI:
InChI=1S/C16H13N3O2/c20-14-6-3-4-11-7-8-13(19-15(11)14)16(21)18-10-12-5-1-2-9-17-12/h1-9,20H,10H2,(H,18,21)
InChI Key:
LRRFOXTVEQTFCM-UHFFFAOYSA-N
SMILES:
O=C(c1ccc2c(n1)c(O)ccc2)NCc1ccccn1
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.101g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
279.299g/mol
Monoisotopic Mass:
279.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
75.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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