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80815-85-6 | 4-methoxy-N-[[phenyl-(5-phenyl-1,2,4-oxadiazol-3-yl)methylidene]amino]aniline
CAS No: 80815-85-6 Catalog No: AG0057X9 MDL No:
Product Description
Catalog Number:
AG0057X9
Chemical Name:
4-methoxy-N-[[phenyl-(5-phenyl-1,2,4-oxadiazol-3-yl)methylidene]amino]aniline
CAS Number:
80815-85-6
Molecular Formula:
C22H18N4O2
Molecular Weight:
370.4039
IUPAC Name:
4-methoxy-N-[(Z)-[phenyl-(5-phenyl-1,2,4-oxadiazol-3-yl)methylidene]amino]aniline
InChI:
InChI=1S/C22H18N4O2/c1-27-19-14-12-18(13-15-19)24-25-20(16-8-4-2-5-9-16)21-23-22(28-26-21)17-10-6-3-7-11-17/h2-15,24H,1H3/b25-20-
InChI Key:
WTAMAFUULWNDDK-QQTULTPQSA-N
SMILES:
COc1ccc(cc1)NN=C(c1noc(n1)c1ccccc1)c1ccccc1
NSC Number:
356350
Properties
Complexity:
495
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
370.143g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
370.412g/mol
Monoisotopic Mass:
370.143g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
72.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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