Home Other Building Blocks 2-(3-carbamoyl-1H-indol-1-yl)acetic acid

2-(3-carbamoyl-1H-indol-1-yl)acetic acid

CAS No.:
1016689-54-5
Catalog Number:
AG019W8G
Molecular Formula:
C11H10N2O3
Molecular Weight:
218.2087
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019W8G
Chemical Name:
2-(3-carbamoyl-1H-indol-1-yl)acetic acid
CAS Number:
1016689-54-5
Molecular Formula:
C11H10N2O3
Molecular Weight:
218.2087
MDL Number:
MFCD09816476
IUPAC Name:
2-(3-carbamoylindol-1-yl)acetic acid
InChI:
InChI=1S/C11H10N2O3/c12-11(16)8-5-13(6-10(14)15)9-4-2-1-3-7(8)9/h1-5H,6H2,(H2,12,16)(H,14,15)
InChI Key:
SGHBCZQKOOSRRQ-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1cc(c2c1cccc2)C(=O)N
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.069g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
218.212g/mol
Monoisotopic Mass:
218.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
85.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties