2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one

C20H12ClFN2O — CID 155671982

IUPAC2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one
SMILESO=c1c2c(F)cccc2nc(-c2ccccc2Cl)n1-c1ccccc1
InChIInChI=1S/C20H12ClFN2O/c21-15-10-5-4-9-14(15)19-23-17-12-6-11-16(22)18(17)20(25)24(19)13-7-2-1-3-8-13/h1-12H
InChIKeySOGSVMDOMUIOJP-UHFFFAOYSA-N
MW350.78 g/mol
LogP4.85
Rot. Bonds2

About 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one

2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one (PubChem CID 155671982) has the molecular formula C20H12ClFN2O and a molecular weight of 350.78 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one.

Molecular Properties

Compound Name2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one
PubChem CID155671982
Molecular FormulaC20H12ClFN2O
Molecular Weight350.78 g/mol
Exact Mass350.06
IUPAC Name2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one
SMILESO=c1c2c(F)cccc2nc(-c2ccccc2Cl)n1-c1ccccc1
InChIInChI=1S/C20H12ClFN2O/c21-15-10-5-4-9-14(15)19-23-17-12-6-11-16(22)18(17)20(25)24(19)13-7-2-1-3-8-13/h1-12H
InChIKeySOGSVMDOMUIOJP-UHFFFAOYSA-N
XLogP4.85
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.78
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-bromo-2-(2-chlorophenyl)-3-phenylquinazolin-4-one
CID 155671998
2-[amino(hydroxy)methyl]-5-fluoro-3-phenylquinazolin-4-one
CID 144894826
lithium 5-fluoro-4-oxo-3-phenylquinazoline-2-carboxylate
CID 139035725
2-(2-chlorophenyl)-8-methyl-3-phenylquinazolin-4-one
CID 155671969
2-(2-chlorophenyl)-3-(2-hydroxyphenyl)quinazolin-4-one
CID 716325
[(1R)-1-(5-fluoro-4-oxo-3-phenylquinazolin-2-yl)propyl] acetate
CID 121455170
5-fluoro-3-phenyl-2-[(2S)-pyrrolidin-2-yl]quinazolin-4-one
CID 137463725
5-chloro-2-[1-[(5-fluoroquinazolin-4-yl)amino]propyl]-3-phenylquinazolin-4-one
CID 155191460
3-(3-chloro-4-methylphenyl)-5-fluoro-2-propylquinazolin-4-one
CID 144835112
[(2S)-2-(5-fluoro-4-oxo-3-phenylquinazolin-2-yl)-3,3-dimethylbutan-2-yl] carbamate
CID 122655078
2-[(1S)-1-aminoethyl]-3-(3,5-dichlorophenyl)-5-fluoroquinazolin-4-one
CID 90235762
3-(2-chloro-6-fluorophenyl)-4-phenyl-1H-1,2,4-triazole-5-thione
CID 115391419

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one?
The IUPAC name of 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one (CID 155671982) is 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one.
What is the SMILES notation for 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one?
The canonical SMILES for 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one is O=c1c2c(F)cccc2nc(-c2ccccc2Cl)n1-c1ccccc1.
What is the InChIKey of 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one?
The InChIKey is SOGSVMDOMUIOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12ClFN2O/c21-15-10-5-4-9-14(15)19-23-17-12-6-11-16(22)18(17)20(25)24(19)13-7-2-1-3-8-13/h1-12H.
What are the key properties of 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one?
2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one has a molecular weight of 350.78 g/mol, XLogP of 4.85, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one is sourced from PubChem (CID 155671982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).