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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
|
M302866-5mg
|
5mg |
2
|
$71.90
|
|
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M302866-10mg
|
10mg |
2
|
$102.90
|
|
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M302866-25mg
|
25mg |
2
|
$165.90
|
|
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M302866-50mg
|
50mg |
2
|
$226.90
|
|
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M302866-100mg
|
100mg |
2
|
$325.90
|
|
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M302866-250mg
|
250mg |
2
|
$733.90
|
|
| Synonyms | CHEBI:92844 | Q27164600 | A857038 | 1-[4-Fluoro-3-(trifluoromethyl)phenyl]-3-[5-(4-pyridinyl)-1,3,4-thiadiaZol-2-yl]urea | WMCOYUSJXXCHFH-UHFFFAOYSA-N | AC-35514 | BCP16264 | EX-A1685 | ML216 | ML-216 | NCGC00189393-09 | MFCD24849400 | AKOS030526519 | MLS |
|---|---|
| Specifications & Purity | ≥99% |
| Storage Temp | Store at -20°C |
| Shipped In |
Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available. |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | N-phenylureas |
| Intermediate Tree Nodes | Not available |
| Direct Parent | N-phenylureas |
| Alternative Parents | Trifluoromethylbenzenes 1,3,4-thiadiazol-2-ylureas Fluorobenzenes Pyridines and derivatives Aryl fluorides Heteroaromatic compounds Ureas Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Trifluoromethylbenzene - N-phenylurea - 1,3,4-thiadiazol-2-ylurea - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Pyridine - Azole - Heteroaromatic compound - Thiadiazole - Urea - Carbonic acid derivative - Azacycle - Organoheterocyclic compound - Alkyl fluoride - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group. |
| External Descriptors | Not available |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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| Pubchem Sid | 504770952 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504770952 |
| IUPAC Name | 1-[4-fluoro-3-(trifluoromethyl)phenyl]-3-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)urea |
| INCHI | InChI=1S/C15H9F4N5OS/c16-11-2-1-9(7-10(11)15(17,18)19)21-13(25)22-14-24-23-12(26-14)8-3-5-20-6-4-8/h1-7H,(H2,21,22,24,25) |
| InChIKey | WMCOYUSJXXCHFH-UHFFFAOYSA-N |
| Smiles | C1=CC(=C(C=C1NC(=O)NC2=NN=C(S2)C3=CC=NC=C3)C(F)(F)F)F |
| Isomeric SMILES | C1=CC(=C(C=C1NC(=O)NC2=NN=C(S2)C3=CC=NC=C3)C(F)(F)F)F |
| Molecular Weight | 383.32 |
| Reaxy-Rn | 23996265 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=23996265&ln= |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Oct 27, 2022 | M302866 | |
| Certificate of Analysis | Oct 27, 2022 | M302866 | |
| Certificate of Analysis | Oct 27, 2022 | M302866 | |
| Certificate of Analysis | Oct 27, 2022 | M302866 | |
| Certificate of Analysis | Oct 27, 2022 | M302866 | |
| Certificate of Analysis | Oct 27, 2022 | M302866 | |
| Certificate of Analysis | Oct 27, 2022 | M302866 |
| Molecular Weight | 383.300 g/mol |
|---|---|
| XLogP3 | 2.800 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 3 |
| Exact Mass | 383.046 Da |
| Monoisotopic Mass | 383.046 Da |
| Topological Polar Surface Area | 108.000 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 491.000 |
| 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 |
| 1. Yan Wu, Jun Zhang, Xintian Wang, Yuncong Xu, Jinxu Zheng. (2023) Saikosaponin-d regulates angiogenesis in idiopathic pulmonary fibrosis through angiopoietin/Tie-2 pathway. ACTA HISTOCHEMICA, 125 (152100). |