3-[3-(2-amino-2-oxoethyl)-1-benzyl-2-ethylindol-5-yl]oxypropylphosphonic acid


Chemical Name: 3-[3-(2-amino-2-oxoethyl)-1-benzyl-2-ethylindol-5-yl]oxypropylphosphonic acid
CAS Number: 164083-84-5
Product Number: AG001UMW(AGN-PC-0JPKQB)
Synonyms:
MDL No:
Molecular Formula: C22H27N2O5P
Molecular Weight: 430.4339

Identification/Properties


Computed Properties
Molecular Weight:
430.441g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
10
Exact Mass:
430.166g/mol
Monoisotopic Mass:
430.166g/mol
Topological Polar Surface Area:
115A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
606
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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