Determine the necessary mass, volume, or concentration for preparing a solution.
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≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C,Argon charged 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
S6K-18 is a highly selective inhibitor ofribosomal protein S6 kinase beta-1 (S6K1, p70S6K, p70-S6K).
Targets
S6K1
| ALogP | 3.274 |
|---|---|
| Conteggio HBD | 3 |
| Legame rotabile | 4 |
| Pubchem Sid | 504771146 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504771146 |
| Sorrisi canonici | CC(C)(C)C1=CC(=C(S1)NC(=O)NC2=CC3=C(C=C2)NN=C3)C(=O)O |
| IUPAC Name | 5-tert-butyl-2-(1H-indazol-5-ylcarbamoylamino)thiophene-3-carboxylic acid |
| InChIKey | BSRFCMMJUFQEOX-UHFFFAOYSA-N |
| INCHI | 1S/C17H18N4O3S/c1-17(2,3)13-7-11(15(22)23)14(25-13)20-16(24)19-10-4-5-12-9(6-10)8-18-21-12/h4-8H,1-3H3,(H,18,21)(H,22,23)(H2,19,20,24) |
| Isomeri SMILES | CC(C)(C)C1=CC(=C(S1)NC(=O)NC2=CC3=C(C=C2)NN=C3)C(=O)O |
| PubChem CID | 53317853 |
| Peso molecolare | 358.41 |
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 |
| Classe | Benzopyrazoles |
| Subclass | Indazoles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Indazoles |
| Alternative Parents | Thiophene carboxylic acids 2,3,5-trisubstituted thiophenes Benzenoids Vinylogous amides Pyrazoles Heteroaromatic compounds Ureas Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Benzopyrazole - Indazole - Thiophene carboxylic acid - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Benzenoid - Azole - Pyrazole - Thiophene - Heteroaromatic compound - Vinylogous amide - Urea - Carboxylic acid - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound |
| Descrizione | This compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Data | Oggetto |
|---|---|---|---|
| Certificate of Analysis | Apr 09, 2025 | S412355 | |
| Certificate of Analysis | Jul 18, 2022 | S412355 | |
| Certificate of Analysis | Jul 18, 2022 | S412355 | |
| Certificate of Analysis | Jul 18, 2022 | S412355 | |
| Certificate of Analysis | Jul 18, 2022 | S412355 |
| Solubilità | Solubility (25°C) In vitro DMSO: 72 mg/mL (200.88 mM); Ethanol: 2 mg/mL (5.58 mM); Water: Insoluble; |
|---|---|
| DMSO (mg/mL) Solubilità massima | 72 |
| DMSO (mM) Solubilità massima | 200.887252029798 |
| Acqua (mg/mL) Solubilità massima | <1 |
| Peso molecolare | 358.400 g/mol |
| XLogP3 | 3.900 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 358.11 Da |
| Monoisotopic Mass | 358.11 Da |
| Topological Polar Surface Area | 135.000 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 525.000 |
| 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 |