Piperazine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-4-(2-(3,5-dimethoxyphenoxy)ethyl)-, dihydrochloride
Basic information
- CAS
57218-06-1- Standard SMILES
COc1cc(OC)cc(OCCN2CCN(CC3COc4ccccc4O3)CC2)c1.Cl.Cl- InChIKey
LLFFBMVRNVZHQU-UHFFFAOYSA-N- Molecular formula
- C23H32Cl2N2O5
- Average molar mass
- 487.4 g/mol
- Monoisotopic mass
- 486.1688275
Names & identifiers
- Preferred name
- Piperazine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-4-(2-(3,5-dimethoxyphenoxy)ethyl)-, dihydrochloride
- IUPAC
- 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-[2-(3,5-dimethoxyphenoxy)ethyl]piperazine;dihydrochloride
Names & synonyms
CRL 4014657218-06-1Piperazine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-4-(2-(3,5-dimethoxyphenoxy)ethyl)-, dihydrochloride1-(2-(1,4-Benzodioxanyl)methyl)-4-(2-(3,5-dimethoxyphenoxy)ethyl)piperazine dihydrochlorideRefChem:371754DTXSID609726731-[(2,3-Dihydro-1,4-benzodioxin-2-yl)methyl]-4-[2-(3,5-dimethoxyphenoxy)ethyl]piperazine--hydrogen chloride (1/2)
Database identifiers
- CAS
57218-06-1- PubChem CID
- 3044397
- DTXSID
DTXSID60972673
Properties
Computed structural properties
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 490
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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