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Home > Imidazoles > 648896-06-4
648896-06-4 | 2-Quinolinecarboxamide, 8-hydroxy-N-[2-(1H-imidazol-4-yl)ethyl]-
CAS No: 648896-06-4 Catalog No: AG006RXQ MDL No:
Product Description
Catalog Number:
AG006RXQ
Chemical Name:
2-Quinolinecarboxamide, 8-hydroxy-N-[2-(1H-imidazol-4-yl)ethyl]-
CAS Number:
648896-06-4
Molecular Formula:
C15H14N4O2
Molecular Weight:
282.2973
IUPAC Name:
8-hydroxy-N-[2-(1H-imidazol-5-yl)ethyl]quinoline-2-carboxamide
InChI:
InChI=1S/C15H14N4O2/c20-13-3-1-2-10-4-5-12(19-14(10)13)15(21)17-7-6-11-8-16-9-18-11/h1-5,8-9,20H,6-7H2,(H,16,18)(H,17,21)
InChI Key:
XDLSDHVPWNTZMS-UHFFFAOYSA-N
SMILES:
O=C(c1ccc2c(n1)c(O)ccc2)NCCc1c[nH]cn1
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.112g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
282.303g/mol
Monoisotopic Mass:
282.112g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
90.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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