8-Fluoro-2H-benzo[b][1,4]oxazin-3(4H)-one - CAS 560082-51-1
Catalog: |
BB029235 |
Product Name: |
8-Fluoro-2H-benzo[b][1,4]oxazin-3(4H)-one |
CAS: |
560082-51-1 |
Synonyms: |
8-fluoro-4H-1,4-benzoxazin-3-one; 8-fluoro-4H-1,4-benzoxazin-3-one |
IUPAC Name: | 8-fluoro-4H-1,4-benzoxazin-3-one |
Description: | 8-Fluoro-2H-benzo[b][1,4]oxazin-3(4H)-one (CAS# 560082-51-1) is a useful research chemical. |
Molecular Weight: | 167.14 |
Molecular Formula: | C8H6FNO2 |
Canonical SMILES: | C1C(=O)NC2=C(O1)C(=CC=C2)F |
InChI: | InChI=1S/C8H6FNO2/c9-5-2-1-3-6-8(5)12-4-7(11)10-6/h1-3H,4H2,(H,10,11) |
InChI Key: | DTRPZILXGOFOKO-UHFFFAOYSA-N |
LogP: | 1.24170 |
Publication Number | Title | Priority Date |
KR-20200131246-A | Heterocyclic compounds as kinase inhibitors | 20180215 |
JP-2021514359-A | Heterocyclic compounds as kinase inhibitors | 20180215 |
WO-2016027249-A1 | Tricyclic nitrogen containing compounds for treating neisseria gonorrhoea infection | 20140822 |
CA-2932056-A1 | Fused imidazole and pyrazole derivatives as modulators of tnf activity | 20131209 |
EP-3080115-A1 | Fused imidazole and pyrazole derivatives as modulators of tnf activity | 20131209 |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 167.0382566 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 167.0382566 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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