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Home Carboxys Ethyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate

Ethyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate

CAS No.:
139481-41-7
Catalog Number:
AG009AAZ
Molecular Formula:
C26H23N3O3
Molecular Weight:
425.4791
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%(HPLC)
In Stock USA
United States
$33
- +
5g
97%(HPLC)
In Stock USA
United States
$61
- +
10g
97%(HPLC)
In Stock USA
United States
$89
- +
25g
97%(HPLC)
In Stock USA
United States
$158
- +
Product Description
Catalog Number:
AG009AAZ
Chemical Name:
Ethyl 1-((2'-cyano-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate
CAS Number:
139481-41-7
Molecular Formula:
C26H23N3O3
Molecular Weight:
425.4791
MDL Number:
MFCD09030636
IUPAC Name:
ethyl 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-ethoxybenzimidazole-4-carboxylate
InChI:
InChI=1S/C26H23N3O3/c1-3-31-25(30)22-10-7-11-23-24(22)29(26(28-23)32-4-2)17-18-12-14-19(15-13-18)21-9-6-5-8-20(21)16-27/h5-15H,3-4,17H2,1-2H3
InChI Key:
GYTTUVXCCHRIBA-UHFFFAOYSA-N
SMILES:
CCOc1nc2c(n1Cc1ccc(cc1)c1ccccc1C#N)c(ccc2)C(=O)OCC
EC Number:
604-136-7
Properties
Complexity:
669  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
425.174g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
425.488g/mol
Monoisotopic Mass:
425.174g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
77.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  
Properties