NSC-33994


Chemical Name: NSC-33994
CAS Number: 82058-16-0
Product Number: AG00G4R1(AGN-PC-0WAG0S)
Synonyms:
MDL No:
Molecular Formula: C28H42N2O2
Molecular Weight: 438.6453

Identification/Properties


Computed Properties
Molecular Weight:
438.656g/mol
XLogP3:
6.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
12
Exact Mass:
438.325g/mol
Monoisotopic Mass:
438.325g/mol
Topological Polar Surface Area:
46.9A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
508
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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