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31C

31C structure

31C 

structure
  • CAS No:

    398515-96-3

  • Formula:

    C35H52N4O7

  • Chemical Name:

    31C

  • Synonyms:

    WPE-III-31C;GAMMA-SECRETASE INHIBITOR XVII;31C;III-31-C;N-[[[(2R,3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxy-4-phenylbutyl](phenylmethyl)amino]carbonyl]-L-leucyl-L-valine methyl ester

31C Basic Attributes

640.80998

640.384

DTXSID40432129

Characteristics

146

5.5

1.135±0.06 g/cm3(Predicted)

DMSO: ≥9mg/mL

-20°C

Safety Information

3

Computed Properties

Molecular Weight:640.8
XLogP3:5.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:18
Exact Mass:640.38360001
Monoisotopic Mass:640.38360001
Topological Polar Surface Area:146
Heavy Atom Count:46
Complexity:955
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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