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Home > Encyclopedia > 2-amino-N-[(2S)-1-[[(2S)-1-[[(2S)-2-(4-nitroanilino)-3-phenylpropanoyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]benzamide

2-amino-N-[(2S)-1-[[(2S)-1-[[(2S)-2-(4-nitroanilino)-3-phenylpropanoyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]benzamide

2-amino-N-[(2S)-1-[[(2S)-1-[[(2S)-2-(4-nitroanilino)-3-phenylpropanoyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]benzamide structure

2-amino-N-[(2S)-1-[[(2S)-1-[[(2S)-2-(4-nitroanilino)-3-phenylpropanoyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]benzamide 

structure
  • CAS No:

    115664-72-7

  • Formula:

    C28H30N6O6

  • Chemical Name:

    2-amino-N-[(2S)-1-[[(2S)-1-[[(2S)-2-(4-nitroanilino)-3-phenylpropanoyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]benzamide

  • Synonyms:

    N-Anthraniloyl-alanyl-alanyl-phenylalanyl-4-nitroanilide; Ant-ala-ala-phe-4NA;

2-amino-N-[(2S)-1-[[(2S)-1-[[(2S)-2-(4-nitroanilino)-3-phenylpropanoyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]benzamide Basic Attributes

546.57400

546.22268270

DTXSID80151165

Characteristics

198.71000

5.59900

1.331g/cm3

908.1ºC at 760mmHg

503ºC

1.643

8.02E-34mmHg at 25°C

Drug Information

Ant-Ala-Ala-Phe-4NA

Computed Properties

Molecular Weight:546.6
XLogP3:3.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:546.22268270
Monoisotopic Mass:546.22268270
Topological Polar Surface Area:188
Heavy Atom Count:40
Complexity:896
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-amino-N-[(2S)-1-[[(2S)-1-[[(2S)-2-(4-nitroanilino)-3-phenylpropanoyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]benzamide

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