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Home > Imidazoles > 36855-68-2
36855-68-2 | Benzamide,N-1H-benzimidazol-2-yl-4-nitro-
CAS No: 36855-68-2 Catalog No: AG0077OR MDL No:
Product Description
Catalog Number:
AG0077OR
Chemical Name:
Benzamide,N-1H-benzimidazol-2-yl-4-nitro-
CAS Number:
36855-68-2
Molecular Formula:
C14H10N4O3
Molecular Weight:
282.2542
IUPAC Name:
N-(1H-benzimidazol-2-yl)-4-nitrobenzamide
InChI:
InChI=1S/C14H10N4O3/c19-13(9-5-7-10(8-6-9)18(20)21)17-14-15-11-3-1-2-4-12(11)16-14/h1-8H,(H2,15,16,17,19)
InChI Key:
ATJLQYUJQCDLFC-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)[N+](=O)[O-])Nc1nc2c([nH]1)cccc2
Properties
Complexity:
404
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.075g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
282.259g/mol
Monoisotopic Mass:
282.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| 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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