(2R)-2-[(4-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid


Chemical Name: (2R)-2-[(4-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid
CAS Number: 39544-74-6
Product Number: AG0078KF(AGN-PC-0JL6UL)
Synonyms:
MDL No: MFCD01123336
Molecular Formula: C18H15ClN2O3
Molecular Weight: 342.7763

Identification/Properties


Computed Properties
Molecular Weight:
342.779g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
342.077g/mol
Monoisotopic Mass:
342.077g/mol
Topological Polar Surface Area:
82.2A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
465
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


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