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350691-55-3 | 5-Quinolinesulfonicacid, 8-hydroxy-2-[[2-(8-quinolinyl)hydrazinylidene]methyl]-
CAS No: 350691-55-3 Catalog No: AG007G0A MDL No:
Product Description
Catalog Number:
AG007G0A
Chemical Name:
5-Quinolinesulfonicacid, 8-hydroxy-2-[[2-(8-quinolinyl)hydrazinylidene]methyl]-
CAS Number:
350691-55-3
Molecular Formula:
C19H14N4O4S
Molecular Weight:
394.4039
IUPAC Name:
8-hydroxy-2-[(E)-(quinolin-8-ylhydrazinylidene)methyl]quinoline-5-sulfonic acid
InChI:
InChI=1S/C19H14N4O4S/c24-16-8-9-17(28(25,26)27)14-7-6-13(22-19(14)16)11-21-23-15-5-1-3-12-4-2-10-20-18(12)15/h1-11,23-24H,(H,25,26,27)/b21-11+
InChI Key:
NFFPJROARQSGIA-SRZZPIQSSA-N
SMILES:
Oc1ccc(c2c1nc(C=NNc1cccc3c1nccc3)cc2)S(=O)(=O)O
Properties
Complexity:
667
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
394.074g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
394.405g/mol
Monoisotopic Mass:
394.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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