Piperazine, 1-acetyl-4-(1-(4-methoxyphenyl)-3-phenylpropyl)-, (Z)-2-butenedioate (1:1)

HCID 6445720

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Basic information

CAS: 40028-25-9
Standard SMILES: COc1ccc(C(CCc2ccccc2)N2CCN(C(C)=O)CC2)cc1.O=C(O)/C=C/C(=O)O
InChIKey: FYLDXCXXTCWMPT-WLHGVMLRSA-N
Molecular formula: C26H32N2O6
Average molar mass: 468.5 g/mol
Monoisotopic mass: 468.22603674

Names & identifiers

Preferred name: Piperazine, 1-acetyl-4-(1-(4-methoxyphenyl)-3-phenylpropyl)-, (Z)-2-butenedioate (1:1)
IUPAC: (E)-but-2-enedioic acid;1-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]ethanone

Names & synonyms

Piperazine, 1-acetyl-4-(1-(4-methoxyphenyl)-3-phenylpropyl)-, (Z)-2-butenedioate (1:1)40028-25-9RefChem:10959861-Acetyl-4-(1-(4-methoxyphenyl)-3-phenylpropyl)piperazine maleate1-(1-(4-Methoxyphenyl)-3-phenylpropyl)-4-acetylpiperazine hydrogen maleate

Database identifiers

CAS: 40028-25-9
PubChem CID: 6445720

Properties

Computed structural properties

Topological polar surface area: 107 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 7
Rotatable bonds: 8
Heavy atoms: 34
Formal charge: 0
Complexity: 539

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