L-Prolinamide, (2R)-2-butyl-N-formyl-N-hydroxy-beta-alanyl-N-(5-fluoro-1-oxido-2-pyridinyl)-

Base Information

Chemical Name:L-Prolinamide, (2R)-2-butyl-N-formyl-N-hydroxy-beta-alanyl-N-(5-fluoro-1-oxido-2-pyridinyl)-
CAS No.:478913-91-6
Molecular Formula:C18H25FN4O5
Molecular Weight:396.41300
Hs Code.:
UNII:027G8KN47F
Wikidata:Q27231499
ChEMBL ID:CHEMBL221667
Mol file:478913-91-6.mol

Synonyms:LBM415;NVP PDF 713;NVP PDF-713;NVP-PDF713

Suppliers and Price of L-Prolinamide, (2R)-2-butyl-N-formyl-N-hydroxy-beta-alanyl-N-(5-fluoro-1-oxido-2-pyridinyl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 2 raw suppliers

Chemical Property of L-Prolinamide, (2R)-2-butyl-N-formyl-N-hydroxy-beta-alanyl-N-(5-fluoro-1-oxido-2-pyridinyl)-

Chemical Property:

PKA:8.73±0.69(Predicted)
PSA：115.41000
Density:1.36±0.1 g/cm3(Predicted)
LogP:2.48450
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:396.18089807
Heavy Atom Count:28
Complexity:694

Purity/Quality:: ≥98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC(CN(C=O)O)C(=O)N1CCCC1C(=O)N=C2C=CC(=CN2O)F
Isomeric SMILES:CCCC[C@H](CN(C=O)O)C(=O)N1CCC[C@H]1C(=O)N=C2C=CC(=CN2O)F

Technology Process of L-Prolinamide, (2R)-2-butyl-N-formyl-N-hydroxy-beta-alanyl-N-(5-fluoro-1-oxido-2-pyridinyl)-

There total 19 articles about L-Prolinamide, (2R)-2-butyl-N-formyl-N-hydroxy-beta-alanyl-N-(5-fluoro-1-oxido-2-pyridinyl)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 478913-93-8
(2S)-N-(5-fluoro-1-oxido-2-pyridinyl)-1-[(2R)-2-[[formyl(phenylmethoxy)amino]methyl]-1-oxohexyl]-2-pyrrolidinecarboxamide

: 478913-91-6
(S)-1-{(R)-2-[(Formyl-hydroxy-amino)-methyl]-hexanoyl}-pyrrolidine-2-carboxylic acid (5-fluoro-1-oxy-pyridin-2-yl)-amide

Guidance literature:: With ammonium formate; palladium on activated charcoal;
DOI:10.1055/s-2006-951499

Reference yield:

: C₇H₁₃O₃^(1-)*Na⁽¹⁺⁾

: 478913-91-6
(S)-1-{(R)-2-[(Formyl-hydroxy-amino)-methyl]-hexanoyl}-pyrrolidine-2-carboxylic acid (5-fluoro-1-oxy-pyridin-2-yl)-amide

Guidance literature:: Multi-step reaction with 7 steps

1: 98 percent / 1-[3-(dimethylamino)propyl]-3-ethylcarbodiimide*HCl / H₂O

2: 98 percent / pyridine

3: K₂CO₃; tetrabutylammonium bromide / tetrahydrofuran / 6 h / 40 °C

4: 96 percent / 2-ethylhexanoic acid / tetrahydrofuran / 7 h / 72 °C

5: Ac₂O / isopropyl acetate / -7 °C

6: CO(NH₂)2; H₂O₂; phthalic anhydride

7: NH₄HCO₂ / Pd/C

With pyridine; phthalic anhydride; 2-Ethylhexanoic acid; tetrabutylammomium bromide; dihydrogen peroxide; ammonium formate; acetic anhydride; potassium carbonate; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; urea; palladium on activated charcoal; In tetrahydrofuran; Isopropyl acetate; water;
DOI:10.1055/s-2006-951499

Reference yield:

: 676127-81-4
(2R)-2-(hydroxymethyl)-N-[(phenylmethyl)oxy]hexanamide

: 478913-91-6
(S)-1-{(R)-2-[(Formyl-hydroxy-amino)-methyl]-hexanoyl}-pyrrolidine-2-carboxylic acid (5-fluoro-1-oxy-pyridin-2-yl)-amide

Guidance literature:: Multi-step reaction with 6 steps

1: 98 percent / pyridine

2: K₂CO₃; tetrabutylammonium bromide / tetrahydrofuran / 6 h / 40 °C

3: 96 percent / 2-ethylhexanoic acid / tetrahydrofuran / 7 h / 72 °C

4: Ac₂O / isopropyl acetate / -7 °C

5: CO(NH₂)2; H₂O₂; phthalic anhydride

6: NH₄HCO₂ / Pd/C

With pyridine; phthalic anhydride; 2-Ethylhexanoic acid; tetrabutylammomium bromide; dihydrogen peroxide; ammonium formate; acetic anhydride; potassium carbonate; urea; palladium on activated charcoal; In tetrahydrofuran; Isopropyl acetate;
DOI:10.1055/s-2006-951499