Home Carboxys Methyl 1-((2'-(2H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate

Methyl 1-((2'-(2H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate

CAS No.:
139481-69-9
Catalog Number:
AG007Z8R
Molecular Formula:
C25H22N6O3
Molecular Weight:
454.4806
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$25
- +
5g
97%
In Stock USA
United States
$75
- +
10g
97%
In Stock USA
United States
$125
- +
25g
97%
In Stock USA
United States
$238
- +
100g
97%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG007Z8R
Chemical Name:
Methyl 1-((2'-(2H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylate
CAS Number:
139481-69-9
Molecular Formula:
C25H22N6O3
Molecular Weight:
454.4806
MDL Number:
MFCD09263633
IUPAC Name:
methyl 2-ethoxy-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate
InChI:
InChI=1S/C25H22N6O3/c1-3-34-25-26-21-10-6-9-20(24(32)33-2)22(21)31(25)15-16-11-13-17(14-12-16)18-7-4-5-8-19(18)23-27-29-30-28-23/h4-14H,3,15H2,1-2H3,(H,27,28,29,30)
InChI Key:
RBPFEPGTRLLUKI-UHFFFAOYSA-N
SMILES:
CCOc1nc2c(n1Cc1ccc(cc1)c1ccccc1c1[nH]nnn1)c(ccc2)C(=O)OC
EC Number:
604-139-3
UNII:
NG25Z8EW4V
Properties
Complexity:
675  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
454.175g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
454.49g/mol
Monoisotopic Mass:
454.175g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  
Properties