2-Bromo-5-methylthiazole-4-carboxylic Acid - CAS 1194374-25-8
Catalog: |
BB004501 |
Product Name: |
2-Bromo-5-methylthiazole-4-carboxylic Acid |
CAS: |
1194374-25-8 |
Synonyms: |
2-bromo-5-methyl-4-thiazolecarboxylic acid; 2-bromo-5-methyl-1,3-thiazole-4-carboxylic acid |
IUPAC Name: | 2-bromo-5-methyl-1,3-thiazole-4-carboxylic acid |
Description: | 2-Bromo-5-methylthiazole-4-carboxylic Acid (CAS# 1194374-25-8) is a derivative of 4-Thiazolecarboxylic Acid (T344195); a chemical reagent used in the synthesis of novel benzimidazole analogs as highly potent hypoxia inducible factor-1α inhibitors that show comparable potency in inhibition of human breast cancer cells. |
Molecular Weight: | 222.06 |
Molecular Formula: | C5H4BrNO2S |
Canonical SMILES: | CC1=C(N=C(S1)Br)C(=O)O |
InChI: | InChI=1S/C5H4BrNO2S/c1-2-3(4(8)9)7-5(6)10-2/h1H3,(H,8,9) |
InChI Key: | XSZIUHFDUUSYKH-UHFFFAOYSA-N |
Appearance: | Solid |
LogP: | 1.91220 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021093172-A1 | Hbv inhibitor and use thereof | 20191113 |
CN-111349105-A | Benzofuran derivative, preparation method and medical application thereof | 20181224 |
TW-201922722-A | Bridged bicyclic compound as a farnesol X receptor modulator | 20171101 |
CN-109195966-A | Kill the thiazole of microorganism | 20160530 |
AU-2015289897-A1 | Spirocycloheptanes as inhibitors of rock | 20140715 |
Complexity: | 155 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.91461 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.91461 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 78.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS