2-Acetamido-4-methylthiazole - CAS 7336-51-8
Catalog: |
BB034829 |
Product Name: |
2-Acetamido-4-methylthiazole |
CAS: |
7336-51-8 |
Synonyms: |
N-(4-methyl-1,3-thiazol-2-yl)acetamide |
IUPAC Name: | N-(4-methyl-1,3-thiazol-2-yl)acetamide |
Description: | 2-Acetamido-4-methylthiazole (CAS# 7336-51-8) is a benzothiazinone analog, which is shown to be the xanthine oxidase inhibitor. |
Molecular Weight: | 156.21 |
Molecular Formula: | C6H8N2OS |
Canonical SMILES: | CC1=CSC(=N1)NC(=O)C |
InChI: | InChI=1S/C6H8N2OS/c1-4-3-10-6(7-4)8-5(2)9/h3H,1-2H3,(H,7,8,9) |
InChI Key: | DPDJXTANWGNJOE-UHFFFAOYSA-N |
Melting Point: | 134-136 °C (lit.) |
Purity: | 95 % |
Density: | 1.285 g/cm3 |
MDL: | MFCD00011561 |
LogP: | 1.48290 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113350347-A | Novel use of indazole compound | 20200305 |
WO-2021174581-A1 | New use of indazole compound | 20200305 |
WO-2021032148-A1 | Aminopyrazine compounds as hpk1 inhibitor and the use thereof | 20190821 |
WO-2020210379-A1 | Phosphatidylinositol 3-kinase inhibitors | 20190410 |
TW-202104223-A | Phosphatidylinositol 3-kinase inhibitors | 20190410 |
PMID | Publication Date | Title | Journal |
12127537 | 20020819 | Design and synthesis of novel inhibitors of gelatinase B | Bioorganic & medicinal chemistry letters |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.03573406 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.03573406 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 70.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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