≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads 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.
Information
Kevetrin hydrochloride Kevetrin hydrochloride (Thioureidobutyronitrile) is a water-soluble, small molecule and activator of the tumor suppressor protein p53 , with potential antineoplastic activity.
| ALogP | 1.105 |
|---|---|
| HBD Count | 1 |
| Rotatable Bond | 4 |
| Pubchem Sid | 504770920 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504770920 |
| Canonical Smiles | C(CC#N)CSC(=N)N.Cl |
| IUPAC Name | 3-cyanopropyl carbamimidothioate;hydrochloride |
| InChIKey | NCXJZJFDQMKRKM-UHFFFAOYSA-N |
| INCHI | 1S/C5H9N3S.ClH/c6-3-1-2-4-9-5(7)8;/h1-2,4H2,(H3,7,8);1H |
| Isomeric SMILES | C(CC#N)CSC(=N)N.Cl |
| Molecular Weight | 179.67 |
| Reaxy-Rn | 3689214 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3689214&ln= |
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 | Organosulfur compounds |
| Class | Isothioureas |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Isothioureas |
| Alternative Parents | Sulfenyl compounds Nitriles Carboximidamides Imines Hydrochlorides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Isothiourea - Sulfenyl compound - Carboximidamide - Nitrile - Carbonitrile - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Imine - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as isothioureas. These are organic compounds containing the isothiourea group, with the general structure R1SC(=NR2)N(R3)R4 (R1,R2,R3,R4=H, alkyl, aryl). |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 E2629039 | Certificate of Analysis | Jun 04, 2026 | K413339 |
| F2229397 | Certificate of Analysis | Apr 03, 2025 | K413339 |
| F2229399 | Certificate of Analysis | Apr 03, 2025 | K413339 |
| F2229400 | Certificate of Analysis | Apr 03, 2025 | K413339 |
| F2229401 | Certificate of Analysis | Apr 03, 2025 | K413339 |
| F2229402 | Certificate of Analysis | Apr 03, 2025 | K413339 |
| F2229403 | Certificate of Analysis | Apr 03, 2025 | K413339 |
| Solubility | Solubility (25°C) In vitro DMSO: 36 mg/mL (200.36 mM); Water: 36 mg/mL (200.36 mM); Ethanol: 21 mg/mL (116.88 mM); |
|---|---|
| DMSO(mg / mL) Max Solubility | 36 |
| DMSO(mM) Max Solubility | 200.36734012356 |
| Water(mg / mL) Max Solubility | 36 |
| Water(mM) Max Solubility | 200.36734012356 |
| Molecular Weight | 179.670 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 179.028 Da |
| Monoisotopic Mass | 179.028 Da |
| Topological Polar Surface Area | 99.000 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 134.000 |
| Isotope Atom Count | 0 |
| 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 | 2 |
