Piperazine, 1-((5,7-dibromo-6-methoxy-3-methylbenzofuran-2-yl)carbonyl)-4-methyl-, hydrochloride

HCID 215431

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Basic information

CAS: 35689-02-2
Standard SMILES: COc1c(Br)cc2c(C)c(C(=O)N3CCN(C)CC3)oc2c1Br.Cl
InChIKey: YCOUAWRIFUYZTO-UHFFFAOYSA-N
Molecular formula: C16H19Br2ClN2O3
Average molar mass: 482.6 g/mol
Monoisotopic mass: 479.9451

Names & identifiers

Preferred name: Piperazine, 1-((5,7-dibromo-6-methoxy-3-methylbenzofuran-2-yl)carbonyl)-4-methyl-, hydrochloride
IUPAC: (5,7-dibromo-6-methoxy-3-methyl-1-benzofuran-2-yl)-(4-methylpiperazin-1-yl)methanone;hydrochloride

Names & synonyms

Piperazine, 1-((5,7-dibromo-6-methoxy-3-methylbenzofuran-2-yl)carbonyl)-4-methyl-, hydrochloride35689-02-2DTXSID10189198RefChem:371818DTXCID40111689(5,7-Dibromo-6-methoxy-3-methyl-1-benzofuran-2-yl)(4-methylpiperazin-1-yl)methanone--hydrogen chloride (1/1)

Database identifiers

CAS: 35689-02-2
PubChem CID: 215431
DTXSID: DTXSID10189198

Properties

Computed structural properties

Topological polar surface area: 45.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 24
Formal charge: 0
Complexity: 445

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