2-(3-Hydroxyphenyl)thiazole-4-carboxylic Acid - CAS 113334-58-0
Catalog: |
BB003159 |
Product Name: |
2-(3-Hydroxyphenyl)thiazole-4-carboxylic Acid |
CAS: |
113334-58-0 |
Synonyms: |
2-(3-hydroxyphenyl)-4-thiazolecarboxylic acid; 2-(3-hydroxyphenyl)-1,3-thiazole-4-carboxylic acid |
IUPAC Name: | 2-(3-hydroxyphenyl)-1,3-thiazole-4-carboxylic acid |
Description: | 2-(3-Hydroxyphenyl)thiazole-4-carboxylic Acid (CAS# 113334-58-0 ) is a useful research chemical. |
Molecular Weight: | 221.23 |
Molecular Formula: | C10H7NO3S |
Canonical SMILES: | C1=CC(=CC(=C1)O)C2=NC(=CS2)C(=O)O |
InChI: | InChI=1S/C10H7NO3S/c12-7-3-1-2-6(4-7)9-11-8(5-15-9)10(13)14/h1-5,12H,(H,13,14) |
InChI Key: | PJBROFATYWROMQ-UHFFFAOYSA-N |
LogP: | 2.21390 |
Publication Number | Title | Priority Date |
EP-2432318-A1 | Bimacrocyclic hcv ns3 protease inhibitors | 20090522 |
US-2012141414-A1 | Bimacrocylic HCV NS3 Protease Inhibitors | 20090522 |
US-2007167622-A1 | Thiazoles as inhibitors of 11B-hydroxysteroid dehydrogenase | 20060118 |
US-7645773-B2 | Thiazoles as inhibitors of 11β-hydroxysteroid dehydrogenase | 20060118 |
Complexity: | 249 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.01466426 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.01466426 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 98.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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