2,5-dioxopyrrolidin-1-yl1-(bicyclo[6.1.0]non-4-yn-9-yl)-3-oxo-2,7,10,13,16-pentaoxa-4-azanonadecan-19-oate


Chemical Name: 2,5-dioxopyrrolidin-1-yl1-(bicyclo[6.1.0]non-4-yn-9-yl)-3-oxo-2,7,10,13,16-pentaoxa-4-azanonadecan-19-oate
CAS Number: 1807501-86-5
Product Number: AG00I06U(AGN-PC-0WAM7Q)
Synonyms:
MDL No:
Molecular Formula:
Molecular Weight:

Identification/Properties


Computed Properties
Molecular Weight:
538.594g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
20
Exact Mass:
538.253g/mol
Monoisotopic Mass:
538.253g/mol
Topological Polar Surface Area:
139A^2
Heavy Atom Count:
38
Formal Charge:
0
Complexity:
833
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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