Penten-3-one, 5-(4-cyclohexylpiperazinyl)-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride
Basic information
- CAS
37151-43-2- Standard SMILES
COc1cc(/C=C/C(=O)CCN2CCN(C3CCCCC3)CC2)cc(OC)c1OC.Cl.Cl- InChIKey
SVQPFJPZAKQLCE-TTWKNDKESA-N- Molecular formula
- C24H38Cl2N2O4
- Average molar mass
- 489.5 g/mol
- Monoisotopic mass
- 488.2208631
Names & identifiers
- Preferred name
- Penten-3-one, 5-(4-cyclohexylpiperazinyl)-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride
- IUPAC
- (E)-5-(4-cyclohexylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-one;dihydrochloride
Names & synonyms
Penten-3-one, 5-(4-cyclohexylpiperazinyl)-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride37151-43-2RefChem:1094555Piperazine, 1-cyclohexyl-4-(2-(3,4,5-trimethoxycinnamoyl)ethyl)-, dihydrochloride
Database identifiers
- CAS
37151-43-2- PubChem CID
- 6445503
Properties
Computed structural properties
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 527
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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