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Home > Imidazoles > 21472-33-3
21472-33-3 | 2H-Benzimidazol-2-one, 5-benzoyl-1,3-dihydro-
CAS No: 21472-33-3 Catalog No: AG00716G MDL No:
Product Description
Catalog Number:
AG00716G
Chemical Name:
2H-Benzimidazol-2-one, 5-benzoyl-1,3-dihydro-
CAS Number:
21472-33-3
Molecular Formula:
C14H10N2O2
Molecular Weight:
238.2414
IUPAC Name:
5-benzoyl-1,3-dihydrobenzimidazol-2-one
InChI:
InChI=1S/C14H10N2O2/c17-13(9-4-2-1-3-5-9)10-6-7-11-12(8-10)16-14(18)15-11/h1-8H,(H2,15,16,18)
InChI Key:
HUBCTWDCEBWLBF-UHFFFAOYSA-N
SMILES:
O=C(c1ccc2c(c1)[nH]c(=O)[nH]2)c1ccccc1
UNII:
63L08710V5
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.074g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.246g/mol
Monoisotopic Mass:
238.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Discovery and design of benzimidazolone based inhibitors of p38 MAP kinase. | Bioorganic & medicinal chemistry letters 20061215 |
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