StemRegenin 1


Chemical Name: StemRegenin 1
CAS Number: 1227633-49-9
Product Number: AG000JF4(AGN-PC-0WAMJA)
Synonyms:
MDL No: MFCD16987861
Molecular Formula: C24H23N5OS
Molecular Weight: 429.5373

Identification/Properties


Computed Properties
Molecular Weight:
429.542g/mol
XLogP3:
5.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
6
Exact Mass:
429.162g/mol
Monoisotopic Mass:
429.162g/mol
Topological Polar Surface Area:
104A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
586
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

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NMR Spectrum


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