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192586-42-8 | Benzenamine, 4,4'-methylenebis[N-(2-pyridinylmethylene)-
CAS No: 192586-42-8 Catalog No: AG002G41 MDL No:
Product Description
Catalog Number:
AG002G41
Chemical Name:
Benzenamine, 4,4'-methylenebis[N-(2-pyridinylmethylene)-
CAS Number:
192586-42-8
Molecular Formula:
C25H20N4
Molecular Weight:
376.4531
IUPAC Name:
1-pyridin-2-yl-N-[4-[[4-(pyridin-2-ylmethylideneamino)phenyl]methyl]phenyl]methanimine
InChI:
InChI=1S/C25H20N4/c1-3-15-26-24(5-1)18-28-22-11-7-20(8-12-22)17-21-9-13-23(14-10-21)29-19-25-6-2-4-16-27-25/h1-16,18-19H,17H2
InChI Key:
OMZVNZJNZUGOJK-UHFFFAOYSA-N
SMILES:
c1ccc(nc1)C=Nc1ccc(cc1)Cc1ccc(cc1)N=Cc1ccccn1
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.169g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
376.463g/mol
Monoisotopic Mass:
376.169g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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