1-(2,2-Dimethoxyethyl)-1,6-dihydro-N-hydroxy-6-oxo-2-phenyl-5-pyrimidinecarboxamide

Base Information

• Chemical Name: 1-(2,2-Dimethoxyethyl)-1,6-dihydro-N-hydroxy-6-oxo-2-phenyl-5-pyrimidinecarboxamide
• CAS No.: 293329-56-3
• Molecular Formula: C₁₅H₁₇N₃O₅
• Molecular Weight: 319.317
• DSSTox Substance ID: DTXSID901129769

Synonyms:SCHEMBL7074782;LMLOABMZOFQEMF-UHFFFAOYSA-N;DTXSID901129769;1-(2,2-Dimethoxyethyl)-1,6-dihydro-N-hydroxy-6-oxo-2-phenyl-5-pyrimidinecarboxamide;n-hydroxy-1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxamide;293329-56-3

Chemical Property of 1-(2,2-Dimethoxyethyl)-1,6-dihydro-N-hydroxy-6-oxo-2-phenyl-5-pyrimidinecarboxamide

Chemical Property:

• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 319.11682065
• Heavy Atom Count: 23
• Complexity: 507

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(CN1C(=NC=C(C1=O)C(=O)NO)C2=CC=CC=C2)OC

Technology Process of 1-(2,2-Dimethoxyethyl)-1,6-dihydro-N-hydroxy-6-oxo-2-phenyl-5-pyrimidinecarboxamide

There total 4 articles about 1-(2,2-Dimethoxyethyl)-1,6-dihydro-N-hydroxy-6-oxo-2-phenyl-5-pyrimidinecarboxamide 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: 91.0%

aqueous hydroxylamine + di-isopropyl ether (108-20-3) + 1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxylic acid (293329-57-4) + isobutyl chloroformate (543-27-1) → N-hydroxy-1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxamide (293329-56-3)

Guidance literature:

With triethylamine; In tetrahydrofuran; water; toluene;

Reference yield:

1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxylic acid (293329-57-4) + isobutyl chloroformate (543-27-1) → N-hydroxy-1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxamide (293329-56-3)

Guidance literature:

With hydroxylamine; triethylamine; In tetrahydrofuran; toluene;

Reference yield:

C20H24N2O7 → N-hydroxy-1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxamide (293329-56-3)

Guidance literature:

With hydroxylamine; In tetrahydrofuran; at 0 ℃; for 0.333333h;

DOI:10.1055/s-2001-10786

upstream raw materials:

1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxylic acid

isobutyl chloroformate

di-isopropyl ether

Downstream raw materials:

N-acetyloxy-1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxamide

N-[(1S)-2-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-1-(methylethyl)-2-oxoethyl]-2-{6-oxo-2-phenyl-5-[(phenylmethoxy)carbonylamino]hydropyrimidinyl}acetamide

5-amino-1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidine

[5-[(benzyloxycarbonyl)amino]-2-phenyl-6-oxo-1,6-dihydro-1-pyrimidinyl]acetaldehyde dimethyl acetal

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