Basic information
- CAS
58493-18-8- Standard SMILES
CCCNC(=O)CN1CCN(C(=O)CCc2cc(OC)c(O)c(OC)c2)CC1.O=C(O)C(=O)O- InChIKey
BJYKVNKBRQWRQQ-UHFFFAOYSA-N- Molecular formula
- C22H33N3O9
- Average molar mass
- 483.5 g/mol
- Monoisotopic mass
- 483.22167964
Names & identifiers
- Preferred name
- 1-Piperazineacetamide, 4-((3,5-dimethoxy-4-hydroxy)dihydrocinnamoyl)-N-propyl-, oxalate
- IUPAC
- 2-[4-[3-(4-hydroxy-3,5-dimethoxyphenyl)propanoyl]piperazin-1-yl]-N-propylacetamide;oxalic acid
Names & synonyms
1-Piperazineacetamide, 4-((3,5-dimethoxy-4-hydroxy)dihydrocinnamoyl)-N-propyl-, oxalate4-((3,5-Dimethoxy-4-hydroxy)dihydrocinnamoyl)-N-propyl-1-piperazineacetamide oxalate58493-18-8DTXSID60207199RefChem:233325DTXCID10129690Oxalic acid--2-{4-[3-(4-hydroxy-3,5-dimethoxyphenyl)propanoyl]piperazin-1-yl}-N-propylacetamide (1/1)
Database identifiers
- CAS
58493-18-8- PubChem CID
- 64898
- DTXSID
DTXSID60207199
Properties
Computed structural properties
- Topological polar surface area
- 166 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 554
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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