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Home > Encyclopedia > (αR)-4-Fluoro-α-[(3S)-4-Methyl-3-[[(5-Methyl-3-isoxazolyl)carbonyl]aMino]-2-oxopentyl]-benzenepropanoicAcid

(αR)-4-Fluoro-α-[(3S)-4-Methyl-3-[[(5-Methyl-3-isoxazolyl)carbonyl]aMino]-2-oxopentyl]-benzenepropanoicAcid

(αR)-4-Fluoro-α-[(3S)-4-Methyl-3-[[(5-Methyl-3-isoxazolyl)carbonyl]aMino]-2-oxopentyl]-benzenepropanoicAcid structure

(αR)-4-Fluoro-α-[(3S)-4-Methyl-3-[[(5-Methyl-3-isoxazolyl)carbonyl]aMino]-2-oxopentyl]-benzenepropanoicAcid 

structure
  • CAS No:

    328086-55-1

  • Formula:

    C20H23FN2O5

  • Chemical Name:

    (αR)-4-Fluoro-α-[(3S)-4-Methyl-3-[[(5-Methyl-3-isoxazolyl)carbonyl]aMino]-2-oxopentyl]-benzenepropanoicAcid

  • Synonyms:

    (αR)-4-Fluoro-α-[(3S)-4-Methyl-3-[[(5-Methyl-3-isoxazolyl)carbonyl]aMino]-2-oxopentyl]-benzenepropanoic Acid;(2R,5S)-2-(4-fluorobenzyl)-6-methyl-5-(5-methylisoxazole-3-carboxamido)-4-oxoheptanoic acid;Benzenepropanoic acid, 4-fluoro-α-[(3S)-4-methyl-3-[[(5-methyl-3-isoxazolyl)carbonyl]amino]-2-oxopentyl]-, (αR)-;(αR)-4-Fluoro-α-[(3S)-4-methyl-3-[[(5-methyl-3-isoxazolyl)carbonyl]amino]-2-oxopentyl]-benzenepropanoic Acid

(αR)-4-Fluoro-α-[(3S)-4-Methyl-3-[[(5-Methyl-3-isoxazolyl)carbonyl]aMino]-2-oxopentyl]-benzenepropanoicAcid Basic Attributes

390.41

390.15910000

Characteristics

109.50000

3.17010

1.251±0.06 g/cm3

605.4±55.0 °C(Predicted)

4.09±0.10

(αR)-4-Fluoro-α-[(3S)-4-Methyl-3-[[(5-Methyl-3-isoxazolyl)carbonyl]aMino]-2-oxopentyl]-benzenepropanoicAcid Use and Manufacturing

Intermediate in the preparation of rhinovirus protease inhibitors.

Computed Properties

Molecular Weight:390.4
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:390.15910000
Monoisotopic Mass:390.15910000
Topological Polar Surface Area:110
Heavy Atom Count:28
Complexity:563
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of (αR)-4-Fluoro-α-[(3S)-4-Methyl-3-[[(5-Methyl-3-isoxazolyl)carbonyl]aMino]-2-oxopentyl]-benzenepropanoicAcid

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