1-Piperazinepropanol, beta-benzyl-alpha-isopropyl-4-methyl-alpha-phenyl-, dihydrochloride
Basic information
- CAS
40502-71-4- Standard SMILES
CC(C)C(O)(c1ccccc1)C(Cc1ccccc1)CN1CCN(C)CC1.Cl.Cl- InChIKey
IRNZJVIEIASJFY-UHFFFAOYSA-N- Molecular formula
- C24H36Cl2N2O
- Average molar mass
- 439.5 g/mol
- Monoisotopic mass
- 438.2204692
Names & identifiers
- Preferred name
- 1-Piperazinepropanol, beta-benzyl-alpha-isopropyl-4-methyl-alpha-phenyl-, dihydrochloride
- IUPAC
- 2-benzyl-4-methyl-1-(4-methylpiperazin-1-yl)-3-phenylpentan-3-ol;dihydrochloride
Names & synonyms
40502-71-41-Piperazinepropanol, beta-benzyl-alpha-isopropyl-4-methyl-alpha-phenyl-, dihydrochlorideRefChem:1056688beta-Benzyl-alpha-isopropyl-4-methyl-alpha-phenyl-1-piperazinepropanol dihydrochloride1-Propanol, 1,3-diphenyl-1-isopropyl-2-(4-methyl-1-piperazinylmethyl)-, dihydrochlorideDTXSID309609012-Benzyl-4-methyl-1-(4-methylpiperazin-1-yl)-3-phenylpentan-3-ol--hydrogen chloride (1/2)
Database identifiers
- CAS
40502-71-4- PubChem CID
- 218346
- DTXSID
DTXSID30960901
Properties
Computed structural properties
- Topological polar surface area
- 26.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 420
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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