6-[(2-nitroimidazol-1-yl)methyl]-1H-pyrimidine-2,4-dione

Base Information

• Chemical Name: 6-[(2-nitroimidazol-1-yl)methyl]-1H-pyrimidine-2,4-dione
• CAS No.: 126401-84-1
• Molecular Formula: C8H7N5O4
• DSSTox Substance ID: DTXSID10449724
• Wikidata: Q82269240
• ChEMBL ID: CHEMBL62331
• Mol file: 126401-84-1.mol

Synonyms:CHEMBL62331;126401-84-1;6-[(2-nitroimidazol-1-yl)methyl]-1H-pyrimidine-2,4-dione;DTXSID10449724;BDBM50122765;6-(2-Nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-dione

Chemical Property of 6-[(2-nitroimidazol-1-yl)methyl]-1H-pyrimidine-2,4-dione

Chemical Property:

• XLogP3: -1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 237.04980372
• Heavy Atom Count: 17
• Complexity: 401

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN(C(=N1)[N+](=O)[O-])CC2=CC(=O)NC(=O)N2

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