4-(3-Bromophenyl)thiazole-2-carboxylic Acid - CAS 808128-00-9
Catalog: |
BB036554 |
Product Name: |
4-(3-Bromophenyl)thiazole-2-carboxylic Acid |
CAS: |
808128-00-9 |
Synonyms: |
4-(3-bromophenyl)-2-thiazolecarboxylic acid; 4-(3-bromophenyl)-1,3-thiazole-2-carboxylic acid |
IUPAC Name: | 4-(3-bromophenyl)-1,3-thiazole-2-carboxylic acid |
Description: | 4-(3-Bromophenyl)thiazole-2-carboxylic Acid (CAS# 808128-00-9 ) is a useful research chemical. |
Molecular Weight: | 284.13 |
Molecular Formula: | C10H6BrNO2S |
Canonical SMILES: | C1=CC(=CC(=C1)Br)C2=CSC(=N2)C(=O)O |
InChI: | InChI=1S/C10H6BrNO2S/c11-7-3-1-2-6(4-7)8-5-15-9(12-8)10(13)14/h1-5H,(H,13,14) |
InChI Key: | XNJWWOHVTKHZBG-UHFFFAOYSA-N |
LogP: | 3.27080 |
Publication Number | Title | Priority Date |
WO-2012061602-A1 | Isoindolinone kinase inhibitors | 20101103 |
CA-2527814-A1 | Isoindolin-1-one compounds as kinase inhibitors | 20030602 |
EP-1633710-A1 | Isoindolin-1-one compounds as kinase inhibitors | 20030602 |
JP-2006526648-A | Isoindoline-1-one compounds as kinase inhibitors | 20030602 |
US-2005026976-A1 | Isoindolinone kinase inhibitors | 20030602 |
Complexity: | 252 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 282.93026 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 282.93026 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 78.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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