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Home > Encyclopedia > 2-[[(2S)-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid

2-[[(2S)-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid

2-[[(2S)-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid structure

2-[[(2S)-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid 

structure
  • CAS No:

    154096-58-9

  • Formula:

    C25H33N3O4

  • Chemical Name:

    2-[[(2S)-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid

  • Synonyms:

    (S)-N-(1-Carboxyethyl)-4-phenyl-L-2-aminobutanoyl-N-phenyl-L-leucinamide; Cepe-gly-leu-PA; L696,418; L-Leucinamide,N-(1-carboxyethyl)-4-phenyl-L-2-aminobutanoyl-N-phenyl-,(S);

2-[[(2S)-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid Basic Attributes

439.54700

439.24710654 g/mol

Characteristics

114.51000

5.10080

1.17g/cm3

713.8ºC

385.5ºC

1.577

2.22E-21mmHg at 25°C

Drug Information

CEPE-Gly-Leu-PA

Computed Properties

Molecular Weight:439.5
XLogP3:1.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:12
Exact Mass:439.24710654
Monoisotopic Mass:439.24710654
Topological Polar Surface Area:108
Heavy Atom Count:32
Complexity:598
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-[[(2S)-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid

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