6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one

C15H9BrFNO — CID 43668193

IUPAC6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one
SMILESO=c1cc(-c2ccccc2)[nH]c2c(F)cc(Br)cc12
InChIInChI=1S/C15H9BrFNO/c16-10-6-11-14(19)8-13(9-4-2-1-3-5-9)18-15(11)12(17)7-10/h1-8H,(H,18,19)
InChIKeyDWBBUBFHQNCMCP-UHFFFAOYSA-N
MW318.14 g/mol
LogP4.10
Rot. Bonds1

About 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one

6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one (PubChem CID 43668193) has the molecular formula C15H9BrFNO and a molecular weight of 318.14 g/mol. Its IUPAC name is 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one.

Molecular Properties

Compound Name6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one
PubChem CID43668193
Molecular FormulaC15H9BrFNO
Molecular Weight318.14 g/mol
Exact Mass316.99
IUPAC Name6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one
SMILESO=c1cc(-c2ccccc2)[nH]c2c(F)cc(Br)cc12
InChIInChI=1S/C15H9BrFNO/c16-10-6-11-14(19)8-13(9-4-2-1-3-5-9)18-15(11)12(17)7-10/h1-8H,(H,18,19)
InChIKeyDWBBUBFHQNCMCP-UHFFFAOYSA-N
XLogP4.10
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.14
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6,8-difluoro-2-phenyl-1H-quinolin-4-one
CID 43668321
7-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one
CID 169130419
7,8-difluoro-2-phenyl-1H-quinolin-4-one
CID 61076472
5,6,8-trifluoro-2-phenyl-1H-quinolin-4-one
CID 62810761
6-bromo-2-ethyl-8-fluoro-1H-quinolin-4-one
CID 43668195
8-fluoro-2-(4-hydroxyphenyl)-1H-quinolin-4-one
CID 66650720
5-bromo-8-chloro-2-phenyl-1H-quinolin-4-one
CID 62909253
7,8-dimethoxy-2-phenyl-1H-quinolin-4-one
CID 11300504
4,9-diphenyl-3,10-diazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),2(6),4,7(11),8,12,14-heptaene
CID 164666039
6,8-difluoro-4-oxo-1H-quinoline-2-carboxylic acid
CID 22017454
5-bromo-6,8-difluoro-1H-quinolin-2-one
CID 102855155
5,7-dihydroxy-8-methoxy-2-phenyl-1H-quinolin-4-one
CID 141354542

Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one?
The IUPAC name of 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one (CID 43668193) is 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one.
What is the SMILES notation for 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one?
The canonical SMILES for 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one is O=c1cc(-c2ccccc2)[nH]c2c(F)cc(Br)cc12.
What is the InChIKey of 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one?
The InChIKey is DWBBUBFHQNCMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9BrFNO/c16-10-6-11-14(19)8-13(9-4-2-1-3-5-9)18-15(11)12(17)7-10/h1-8H,(H,18,19).
What are the key properties of 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one?
6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one has a molecular weight of 318.14 g/mol, XLogP of 4.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-fluoro-2-phenyl-1H-quinolin-4-one is sourced from PubChem (CID 43668193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).