≥98 atom% D,≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Labelled Ziprasidone. Combined serotonin (5HT2) and dopamine (D2) receptor antagonist. Used as an antipsychotic.
Ziprasidone-d8 is a stable isotope-labeled analogue of ziprasidone, where eight hydrogen atoms are replaced with deuterium. This compound is utilized in research as an internal standard for the quantification of ziprasidone using mass spectrometric techniques, such as liquid chromatography-tandem mass spectrometry (LC-MS/MS). The incorporation of deuterium atoms into the molecule provides a mass difference that allows for the clear distinction between ziprasidone-d8 and the non-labeled ziprasidone in analytical assays. Researchers utilize ziprasidone-d8 to investigate the absorption, distribution, metabolism, and excretion (ADME) of ziprasidone in various biological matrices. The application of this deuterated compound is particularly valuable in the field of analytical chemistry to calibrate instruments and validate methodologies that require precise and accurate measurements of ziprasidone in experimental and biological samples. The use of ziprasidone-d8 aids in enhancing the reliability of research findings in studies where understanding the behavior of ziprasidone is critical.
| Pubchem Sid | 528776732 |
|---|---|
| Canonical Smiles | C1CN(CCN1CCC2=C(C=C3C(=C2)CC(=O)N3)Cl)C4=NSC5=CC=CC=C54 |
| IUPAC Name | 5-[2-[4-(1,2-benzothiazol-3-yl)-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl]ethyl]-6-chloro-1,3-dihydroindol-2-one |
| InChIKey | MVWVFYHBGMAFLY-UFBJYANTSA-N |
| INCHI | 1S/C21H21ClN4OS/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)28-24-21/h1-4,11,13H,5-10,12H2,(H,23,27)/i7D2,8D2,9D2,10D2 |
| Isomeric SMILES | [2H]C1(C(N(C(C(N1CCC2=C(C=C3C(=C2)CC(=O)N3)Cl)([2H])[2H])([2H])[2H])C4=NSC5=CC=CC=C54)([2H])[2H])[2H] |
| Alternate CAS | 146939-27-7（unlabelled） |
| PubChem CID | 25216238 |
| Molecular Weight | 420.98 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Diazinanes |
| Subclass | Piperazines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | N-arylpiperazines |
| Alternative Parents | Phenethylamines Indolines Benzothiazoles Dialkylarylamines N-alkylpiperazines Aralkylamines Aminothiazoles Imidolactams Aryl chlorides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | N-arylpiperazine - Indole or derivatives - Dihydroindole - 1,2-benzothiazole - Phenethylamine - Dialkylarylamine - Aralkylamine - N-alkylpiperazine - 1,2-thiazolamine - Aryl chloride - Aryl halide - Imidolactam - Benzenoid - Heteroaromatic compound - Azole - Thiazole - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Lactam - Azacycle - Carboxylic acid derivative - Amine - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl group. |
| External Descriptors | Not available |
| Solubility | Soluble in DMSO and Methanol (Slightly) |
|---|---|
| Melt Point(°C) | >206° C (dec.) |
| Molecular Weight | 421.000 g/mol |
| XLogP3 | 4.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 420.163 Da |
| Monoisotopic Mass | 420.163 Da |
| Topological Polar Surface Area | 76.700 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 573.000 |
| Isotope Atom Count | 8 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
I2426146