Home Other Building Blocks Nepafenac-D5

Nepafenac-D5

CAS No.:
1246814-53-8
Catalog Number:
AG009CJC
Molecular Formula:
C15H9D5N2O2
Molecular Weight:
259.3147
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$1168
- +
10mg
98%
1 week
United States
$1862
- +
Product Description
Catalog Number:
AG009CJC
Chemical Name:
Nepafenac-D5
CAS Number:
1246814-53-8
Molecular Formula:
C15H9D5N2O2
Molecular Weight:
259.3147
MDL Number:
MFCD08067732
IUPAC Name:
2-[2-amino-3-(2,3,4,5,6-pentadeuteriobenzoyl)phenyl]acetamide
InChI:
InChI=1S/C15H14N2O2/c16-13(18)9-11-7-4-8-12(14(11)17)15(19)10-5-2-1-3-6-10/h1-8H,9,17H2,(H2,16,18)/i1D,2D,3D,5D,6D
InChI Key:
QEFAQIPZVLVERP-XFEWCBMOSA-N
SMILES:
NC(=O)Cc1cccc(c1N)C(=O)c1c([2H])c([2H])c(c(c1[2H])[2H])[2H]
Properties
Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.137g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
5  
Molecular Weight:
259.32g/mol
Monoisotopic Mass:
259.137g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties