Cas no 289472-81-7 ((S)-Hydroxy Des(boric Acid) Bortezomib)

(S)-Hydroxy Des(boric Acid) Bortezomib is a modified derivative of the proteasome inhibitor bortezomib, where the boronic acid moiety is replaced by a hydroxyl group. This structural alteration enhances its stability and reduces potential off-target interactions associated with boronic acid-containing compounds. The (S)-configuration ensures high stereoselectivity, improving binding affinity to the 20S proteasome's active site. This compound retains potent inhibitory activity against the chymotrypsin-like proteasomal function, making it valuable for studying proteasome-dependent pathways in cellular and biochemical assays. Its improved solubility and reduced reactivity compared to bortezomib facilitate experimental handling while maintaining pharmacological relevance in research applications.
(S)-Hydroxy Des(boric Acid) Bortezomib structure
289472-81-7 structure
Product Name:(S)-Hydroxy Des(boric Acid) Bortezomib
CAS No:289472-81-7
MF:C19H24N4O3
MW:356.418864250183
CID:1030960
PubChem ID:71607434
Update Time:2025-07-02

(S)-Hydroxy Des(boric Acid) Bortezomib Chemical and Physical Properties

Names and Identifiers

    • N-((S)-1-(((S)-1-Hydroxy-3-methylbutyl)amino)-1-oxo-3-phenylpropan-2-yl)pyrazine-2-carboxamide
    • (S)-Hydroxy Des(boric Acid) Bortezomib
    • N-[(2S)-1-[[(1S)-1-hydroxy-3-methylbutyl]amino]-1-oxo-3-phenylpropan-2-yl]pyrazine-2-carboxamide
    • Bortezomib Impurity J
    • 2-Pyrazinecarboxamide, N-((1S)-2-(((1S)-1-hydroxy-3-methylbutyl)amino)-2-oxo-1-(phenylmethyl)ethyl)-
    • N-[(1S)-2-[[(1S)-1-Hydroxy-3-methylbutyl]amino]-2-oxo-1-(phenylmethyl)ethyl]-2-pyrazinecarboxamide
    • Hydroxy des(boric acid) bortezomib, (S)-
    • SCHEMBL24390721
    • BGP3WC2T3P
    • 2-Pyrazinecarboxamide, N-[(1S)-2-[[(1S)-1-hydroxy-3-methylbutyl]amino]-2-oxo-1-(phenylmethyl)ethyl]-; N-[(1S)-2-[[(1S)-1-Hydroxy-3-methylbutyl]amino]-2-oxo-1-(phenylmethyl)ethyl]-2-pyrazinecarboxamide; (S,S)-Bortezomib hydroxyisopentyl amide analog (USP); Bortezomib Impurity 48
    • DTXSID40856381
    • NEIDLJIPMZVISC-RDJZCZTQSA-N
    • 289472-81-7
    • UNII-BGP3WC2T3P
    • N-[(1S)-1-Hydroxy-3-methylbutyl]-Nalpha-(pyrazine-2-carbonyl)-L-phenylalaninamide
    • 2-Pyrazinecarboxamide, N-[(1S)-2-[[(1S)-1-hydroxy-3-methylbutyl]amino]-2-oxo-1-(phenylmethyl)ethyl]-
    • Bortezomib Impurity G
    • DB-230860
    • (2S)-N-[(1S)-1-HYDROXY-3-METHYLBUTYL]-3-PHENYL-2-(PYRAZIN-2-YLFORMAMIDO)PROPANAMIDE
    • Bortezomib (m2)
    • AKOS016844880
    • MDL: MFCD26940315
    • Inchi: 1S/C19H24N4O3/c1-13(2)10-17(24)23-18(25)15(11-14-6-4-3-5-7-14)22-19(26)16-12-20-8-9-21-16/h3-9,12-13,15,17,24H,10-11H2,1-2H3,(H,22,26)(H,23,25)/t15-,17-/m0/s1
    • InChI Key: NEIDLJIPMZVISC-RDJZCZTQSA-N
    • SMILES: O[C@@H](CC(C)C)NC([C@H](CC1C=CC=CC=1)NC(C1C=NC=CN=1)=O)=O

Computed Properties

  • Exact Mass: 356.18484064g/mol
  • Monoisotopic Mass: 356.18484064g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 10
  • Complexity: 452
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.9
  • Topological Polar Surface Area: 104?2

Experimental Properties

  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 672.0±55.0 °C at 760 mmHg
  • Flash Point: 360.2±31.5 °C
  • Vapor Pressure: 0.0±2.2 mmHg at 25°C

(S)-Hydroxy Des(boric Acid) Bortezomib Security Information

(S)-Hydroxy Des(boric Acid) Bortezomib Pricemore >>

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