3-Bromo-5-(trifluoromethyl)-4-azaindole - CAS 1190320-16-1
Catalog: |
BB004393 |
Product Name: |
3-Bromo-5-(trifluoromethyl)-4-azaindole |
CAS: |
1190320-16-1 |
Synonyms: |
3-bromo-5-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine; 3-bromo-5-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine |
IUPAC Name: | 3-bromo-5-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine |
Description: | 3-Bromo-5-(trifluoromethyl)-4-azaindole (CAS# 1190320-16-1) is a useful research chemical. |
Molecular Weight: | 265.03 |
Molecular Formula: | C8H4BrF3N2 |
Canonical SMILES: | C1=CC(=NC2=C1NC=C2Br)C(F)(F)F |
InChI: | InChI=1S/C8H4BrF3N2/c9-4-3-13-5-1-2-6(8(10,11)12)14-7(4)5/h1-3,13H |
InChI Key: | IPMFTOAKMLJDLY-UHFFFAOYSA-N |
LogP: | 3.34420 |
Publication Number | Title | Priority Date |
EP-2548876-A1 | New CRTh2 antagonists | 20110718 |
Complexity: | 221 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.951 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.951 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 28.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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