≥97% 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.
Premature-termination-codons readthrough compounds; Premature-termination-codons readthrough compounds; Induce Read Through;
| Pubchem Sid | 504760170 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504760170 |
| Canonical Smiles | CNC(=S)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3 |
| IUPAC Name | 4-(1,3-benzodioxol-5-ylmethyl)-N-methylpiperazine-1-carbothioamide |
| InChIKey | KSYXTHPSLVVZBD-UHFFFAOYSA-N |
| INCHI | 1S/C14H19N3O2S/c1-15-14(20)17-6-4-16(5-7-17)9-11-2-3-12-13(8-11)19-10-18-12/h2-3,8H,4-7,9-10H2,1H3,(H,15,20) |
| Isomeric SMILES | CNC(=S)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3 |
| PubChem CID | 796306 |
| Molecular Weight | 293.40 |
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 | Benzodioxoles |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzodioxoles |
| Alternative Parents | N-alkylpiperazines Aralkylamines Benzenoids Trialkylamines Thioureas Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Benzodioxole - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Benzenoid - Tertiary amine - Thiourea - Tertiary aliphatic amine - Acetal - Oxacycle - Azacycle - Organopnictogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms. |
| 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 |
|---|---|---|---|
 I2222124 | Certificate of Analysis | Jul 10, 2025 | W416822 |
| I2222125 | Certificate of Analysis | Jul 10, 2025 | W416822 |
| I2222126 | Certificate of Analysis | Jul 10, 2025 | W416822 |
| I2222127 | Certificate of Analysis | Jul 10, 2025 | W416822 |
| Molecular Weight | 293.390 g/mol |
|---|---|
| XLogP3 | 1.500 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 293.12 Da |
| Monoisotopic Mass | 293.12 Da |
| Topological Polar Surface Area | 69.100 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 347.000 |
| 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 | 1 |
