Calindol Amide-13C


Chemical Name: Calindol Amide-13C
CAS Number: 1217782-43-8
Product Number: AG009F9K(AGN-PC-0WAGN8)
Synonyms:
MDL No:
Molecular Formula: C21H18N2O
Molecular Weight: 315.373074838

Identification/Properties


Computed Properties
Molecular Weight:
315.38g/mol
XLogP3:
4.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
3
Exact Mass:
315.145g/mol
Monoisotopic Mass:
315.145g/mol
Topological Polar Surface Area:
44.9A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
451
Isotope Atom Count:
1
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
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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