5-Bromo-6-(4-nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-dione

Base Information

• Chemical Name: 5-Bromo-6-(4-nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-dione
• CAS No.: 840527-13-1
• Molecular Formula: C8H6BrN5O4
• ChEMBL ID: CHEMBL191863
• DSSTox Substance ID: DTXSID101150930

Synonyms:CHEMBL191863;DTXSID101150930;5-Bromo-6-(4-nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-dione;BDBM50159222;840527-13-1;PD095839;5-Bromo-6-[(4-nitro-1H-imidazol-1-yl)methyl]-2,4(1H,3H)-pyrimidinedione

Chemical Property of 5-Bromo-6-(4-nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-dione

Chemical Property:

• XLogP3: -0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 314.96032
• Heavy Atom Count: 18
• Complexity: 445

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MSDS Files:

Useful:

• Canonical SMILES: C1=C(N=CN1CC2=C(C(=O)NC(=O)N2)Br)[N+](=O)[O-]

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