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Home > Imidazoles > 88422-58-6
88422-58-6 | Methanone, [5-(1-methyl-1H-benzimidazol-2-yl)-2-thienyl]phenyl-
CAS No: 88422-58-6 Catalog No: AG004EVZ MDL No:
Product Description
Catalog Number:
AG004EVZ
Chemical Name:
Methanone, [5-(1-methyl-1H-benzimidazol-2-yl)-2-thienyl]phenyl-
CAS Number:
88422-58-6
Molecular Formula:
C19H14N2OS
Molecular Weight:
318.3923
IUPAC Name:
[5-(1-methylbenzimidazol-2-yl)thiophen-2-yl]-phenylmethanone
InChI:
InChI=1S/C19H14N2OS/c1-21-15-10-6-5-9-14(15)20-19(21)17-12-11-16(23-17)18(22)13-7-3-2-4-8-13/h2-12H,1H3
InChI Key:
VIYUPCGLZMHTDJ-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(s1)c1nc2c(n1C)cccc2)c1ccccc1
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.083g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.394g/mol
Monoisotopic Mass:
318.083g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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