1-(2,5-Dibromo-3-methylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)ethanol

HCID 178443

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Basic information

CAS: 138335-72-5
Standard SMILES: Cc1cnc(CC(O)c2c(Br)nc(Br)n2C)cn1
InChIKey: HODKYPSVSROPHE-UHFFFAOYSA-N
Molecular formula: C11H12Br2N4O
Average molar mass: 376.05 g/mol
Monoisotopic mass: 373.93779

Names & identifiers

Preferred name: 1-(2,5-Dibromo-3-methylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)ethanol
IUPAC: 1-(2,5-dibromo-3-methylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)ethanol

Names & synonyms

138335-72-51-(2,5-dibromo-3-methylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)ethanolDTXSID50930060Ethanol, 1-(2,5-dibromo-3-methylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)-1-(2,4-Dibromo-1-methyl-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethan-1-ol

Database identifiers

CAS: 138335-72-5
PubChem CID: 178443
DTXSID: DTXSID50930060

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 63.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 18
Formal charge: 0
Complexity: 284

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