6-(4-Nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-dione

Base Information

• Chemical Name: 6-(4-Nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-dione
• CAS No.: 126401-73-8
• Molecular Formula: C8H7N5O4
• ChEMBL ID: CHEMBL371804
• DSSTox Substance ID: DTXSID801173587
• Mol file: 126401-73-8.mol

Synonyms:CHEMBL371804;6-(4-Nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-dione;DTXSID801173587;BDBM50159218;126401-73-8;6-[(4-Nitro-1H-imidazol-1-yl)methyl]-2,4(1H,3H)-pyrimidinedione

Chemical Property of 6-(4-Nitro-imidazol-1-ylmethyl)-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

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MSDS Files:

Useful:

• Canonical SMILES: C1=C(NC(=O)NC1=O)CN2C=C(N=C2)[N+](=O)[O-]

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