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Home > Imidazoles > 120187-29-3
120187-29-3 | 1H-Benzimidazole-2-carboxamide, N-(4-ethoxyphenyl)-
CAS No: 120187-29-3 Catalog No: AG000QIW MDL No:
Product Description
Catalog Number:
AG000QIW
Chemical Name:
1H-Benzimidazole-2-carboxamide, N-(4-ethoxyphenyl)-
CAS Number:
120187-29-3
Molecular Formula:
C16H15N3O2
Molecular Weight:
281.3092
IUPAC Name:
N-(4-ethoxyphenyl)-1H-benzimidazole-2-carboxamide
InChI:
InChI=1S/C16H15N3O2/c1-2-21-12-9-7-11(8-10-12)17-16(20)15-18-13-5-3-4-6-14(13)19-15/h3-10H,2H2,1H3,(H,17,20)(H,18,19)
InChI Key:
LUOOPIHVXHZLOP-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)NC(=O)c1nc2c([nH]1)cccc2
EC Number:
407-600-5
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.116g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.315g/mol
Monoisotopic Mass:
281.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
67A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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