3,7-Diazabicyclo(3.3.1)nonane, 3-diphenylmethyl-7-methyl-, hydrochloride

HCID 47342

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Basic information

CAS: 64304-24-1
Standard SMILES: C[NH+]1CC2CC(CN(C(c3ccccc3)c3ccccc3)C2)C1.[Cl-]
InChIKey: ALHWTQFNZXITBS-UHFFFAOYSA-N
Molecular formula: C21H27ClN2
Average molar mass: 342.9 g/mol
Monoisotopic mass: 342.1862766

Names & identifiers

Preferred name: 3,7-Diazabicyclo(3.3.1)nonane, 3-diphenylmethyl-7-methyl-, hydrochloride
IUPAC: 3-benzhydryl-7-methyl-3-aza-7-azoniabicyclo[3.3.1]nonane chloride

Names & synonyms

3-Diphenylmethyl-7-methylbispidine hydrochloride64304-24-13-Diphenylmethyl-7-methyl-3,7-diazabicyclo(3.3.1)nonane hydrochloride3,7-DIAZABICYCLO(3.3.1)NONANE, 3-DIPHENYLMETHYL-7-METHYL-, HYDROCHLORIDERefChem:272536

Database identifiers

CAS: 64304-24-1
PubChem CID: 47342

Properties

Computed structural properties

Topological polar surface area: 7.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 24
Formal charge: 0
Complexity: 338

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