Piperazine, 1-((1-(4-ethoxyphenyl)-5-oxo-2-phenyl-3-pyrrolidinyl)carbonyl)-, monohydrochloride, trans-
Basic information
- CAS
38123-89-6- Standard SMILES
CCOc1ccc(N2C(=O)C[C@H](C(=O)N3CCNCC3)[C@H]2c2ccccc2)cc1.Cl- InChIKey
MJXMHGWDKKVVSA-IKGOIYPNSA-N- Molecular formula
- C23H28ClN3O3
- Average molar mass
- 429.9 g/mol
- Monoisotopic mass
- 429.1819195
Names & identifiers
- Preferred name
- Piperazine, 1-((1-(4-ethoxyphenyl)-5-oxo-2-phenyl-3-pyrrolidinyl)carbonyl)-, monohydrochloride, trans-
- IUPAC
- (4S,5S)-1-(4-ethoxyphenyl)-5-phenyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride
Names & synonyms
38123-89-6Piperazine, 1-((1-(4-ethoxyphenyl)-5-oxo-2-phenyl-3-pyrrolidinyl)carbonyl)-, monohydrochloride, trans-RefChem:1095650Trans-1-(4-ethoxyphenyl)-5-phenyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one hydrochloridetrans-(p-Ethoxyphenyl)-1 oxo-2 piperazinocarbonyl-4 phenyl-5 pyrrolidine chlorhydrate [French]trans-(p-Ethoxyphenyl)-1 oxo-2 piperazinocarbonyl-4 phenyl-5 pyrrolidine chlorhydrate
Database identifiers
- CAS
38123-89-6- PubChem CID
- 217110
Properties
Computed structural properties
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 564
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Compound notes
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