RefChem:1079455
(E)-1-[4-(2-hydroxy-2-phenylpropyl)piperazin-4-ium-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one chloride
Also Known As: Benzyl alcohol, alpha-methyl-alpha-(4-(3,4,5-trimethoxycinnamoyl)piperazinylmethyl)-, hydrochloride, hydrate|BENZYL ALCOHOL, alpha-METHYL-alpha-(4-(3,4,5-TRIMETHOXYCINNAMOYL)PIPERAZINYLMETH|(E)-1-[4-(2-hydroxy-2-phenylpropyl)piperazin-4-ium-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one chloride|1-Piperazineethanol, .alpha.-methyl-4-[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]-.alpha.-phenyl-, monohydrochloride, monohydrate
| Molecular Formula | C25H33ClN2O5 |
|---|---|
| Molecular Weight | 476.2078 g/mol |
| LogP | -1.6356 |
| Topological Polar Surface Area | 72.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 476.2078 |
| Monoisotopic Mass | 476.2078 |
| Heavy Atoms | 33 |
| Complexity | 916.0635 |
Chemical Identifiers
| CAS Number | 72004-06-9 |
|---|---|
| SMILES | CC(C[NH+]1CCN(CC1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)OC)OC)(C3=CC=CC=C3)O.[Cl-] |
Product Overview
RefChem:1079455 (CAS 72004-06-9), with molecular formula C25H33ClN2O5 and molecular weight 476.2078 g/mol. IUPAC: (E)-1-[4-(2-hydroxy-2-phenylpropyl)piperazin-4-ium-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one chloride.