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915978-89-1 | Benzenecarboximidamide, 4,4'-[2,2'-bifuran]-5,5'-diylbis[N-hydroxy-
CAS No: 915978-89-1 Catalog No: AG006FVW MDL No:
Product Description
Catalog Number:
AG006FVW
Chemical Name:
Benzenecarboximidamide, 4,4'-[2,2'-bifuran]-5,5'-diylbis[N-hydroxy-
CAS Number:
915978-89-1
Molecular Formula:
C22H18N4O4
Molecular Weight:
402.4027
IUPAC Name:
N'-hydroxy-4-[5-[5-[4-[(Z)-N'-hydroxycarbamimidoyl]phenyl]furan-2-yl]furan-2-yl]benzenecarboximidamide
InChI:
InChI=1S/C22H18N4O4/c23-21(25-27)15-5-1-13(2-6-15)17-9-11-19(29-17)20-12-10-18(30-20)14-3-7-16(8-4-14)22(24)26-28/h1-12,27-28H,(H2,23,25)(H2,24,26)
InChI Key:
AZVYBOWEOYDLRW-UHFFFAOYSA-N
SMILES:
ONC(=N)c1ccc(cc1)c1ccc(o1)c1ccc(o1)c1ccc(cc1)C(=N)NO
Properties
Complexity:
573
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
402.133g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
402.41g/mol
Monoisotopic Mass:
402.133g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
144A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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