5-(3-Bromo-4-fluorophenyl)-2H-tetrazole - CAS 874784-10-8
Catalog: |
BB038478 |
Product Name: |
5-(3-Bromo-4-fluorophenyl)-2H-tetrazole |
CAS: |
874784-10-8 |
Synonyms: |
5-(3-bromo-4-fluorophenyl)-2H-tetrazole; 5-(3-bromo-4-fluorophenyl)-2H-tetrazole |
IUPAC Name: | 5-(3-bromo-4-fluorophenyl)-2H-tetrazole |
Description: | 5-(3-Bromo-4-fluorophenyl)-2H-tetrazole (CAS# 874784-10-8) is a useful research chemical. |
Molecular Weight: | 243.04 |
Molecular Formula: | C7H4BrFN4 |
Canonical SMILES: | C1=CC(=C(C=C1C2=NNN=N2)Br)F |
InChI: | InChI=1S/C7H4BrFN4/c8-5-3-4(1-2-6(5)9)7-10-12-13-11-7/h1-3H,(H,10,11,12,13) |
InChI Key: | PTGKEXZJIQANKQ-UHFFFAOYSA-N |
LogP: | 1.76830 |
Publication Number | Title | Priority Date |
US-2006211739-A1 | Use of selective P2X7 receptor antagonists | 20050208 |
WO-2006086229-A1 | The use of selective p2x7 receptor antagonists | 20050208 |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.96034 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.96034 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 54.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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