Home Aminos 4-([4-(1H-Benzimidazol-2-yl)phenyl]amino)-4-oxobutanoic acid

4-([4-(1H-Benzimidazol-2-yl)phenyl]amino)-4-oxobutanoic acid

CAS No.:
27031-00-1
Catalog Number:
AG00I54S
Molecular Formula:
C17H15N3O3
Molecular Weight:
309.3193
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$75
- +
1g
95%
In Stock USA
United States
$157
- +
5g
95%
In Stock USA
United States
$544
- +
10g
95%
In Stock USA
United States
$925
- +
Product Description
Catalog Number:
AG00I54S
Chemical Name:
4-([4-(1H-Benzimidazol-2-yl)phenyl]amino)-4-oxobutanoic acid
CAS Number:
27031-00-1
Molecular Formula:
C17H15N3O3
Molecular Weight:
309.3193
MDL Number:
MFCD00395378
IUPAC Name:
4-[4-(1H-benzimidazol-2-yl)anilino]-4-oxobutanoic acid
InChI:
InChI=1S/C17H15N3O3/c21-15(9-10-16(22)23)18-12-7-5-11(6-8-12)17-19-13-3-1-2-4-14(13)20-17/h1-8H,9-10H2,(H,18,21)(H,19,20)(H,22,23)
InChI Key:
ARVPDCQNTCJVSU-UHFFFAOYSA-N
SMILES:
OC(=O)CCC(=O)Nc1ccc(cc1)c1nc2c([nH]1)cccc2
Properties
Complexity:
435  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.111g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
309.325g/mol
Monoisotopic Mass:
309.111g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
95.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties