Pregnan-20-one, 21-chloro-3-hydroxy-2-(4-morpholinyl)-, (2b,3a,5a)-


Chemical Name: Pregnan-20-one, 21-chloro-3-hydroxy-2-(4-morpholinyl)-, (2b,3a,5a)-
CAS Number: 156685-94-8
Product Number: AG00ASXQ(AGN-PC-0O4H08)
Synonyms:
MDL No:
Molecular Formula: C25H40ClNO3
Molecular Weight: 438.0430

Identification/Properties


Computed Properties
Molecular Weight:
438.049g/mol
XLogP3:
4.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
437.27g/mol
Monoisotopic Mass:
437.27g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
667
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
9
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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