3-(2,4-difluorophenyl)-2-methylquinazolin-4-one

C15H10F2N2O — CID 2824755

IUPAC3-(2,4-difluorophenyl)-2-methylquinazolin-4-one
SMILESCc1nc2ccccc2c(=O)n1-c1ccc(F)cc1F
InChIInChI=1S/C15H10F2N2O/c1-9-18-13-5-3-2-4-11(13)15(20)19(9)14-7-6-10(16)8-12(14)17/h2-8H,1H3
InChIKeyHCJPLIMIYWMBRS-UHFFFAOYSA-N
MW272.25 g/mol
LogP2.97
Rot. Bonds1

About 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one

3-(2,4-difluorophenyl)-2-methylquinazolin-4-one (PubChem CID 2824755) has the molecular formula C15H10F2N2O and a molecular weight of 272.25 g/mol. Its IUPAC name is 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one.

Molecular Properties

Compound Name3-(2,4-difluorophenyl)-2-methylquinazolin-4-one
PubChem CID2824755
Molecular FormulaC15H10F2N2O
Molecular Weight272.25 g/mol
Exact Mass272.08
IUPAC Name3-(2,4-difluorophenyl)-2-methylquinazolin-4-one
SMILESCc1nc2ccccc2c(=O)n1-c1ccc(F)cc1F
InChIInChI=1S/C15H10F2N2O/c1-9-18-13-5-3-2-4-11(13)15(20)19(9)14-7-6-10(16)8-12(14)17/h2-8H,1H3
InChIKeyHCJPLIMIYWMBRS-UHFFFAOYSA-N
XLogP2.97
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.25
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,4-difluorophenyl)-2-propan-2-ylsulfanylquinazolin-4-one
CID 2365337
3-(4-hydroxy-2-methylphenyl)-2-methylquinazolin-4-one
CID 21143
2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-3-(2,4-difluorophenyl)quinazolin-4-one
CID 3631266
3-(2,4-difluorophenyl)-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanylquinazolin-4-one
CID 32698535
3-(2,4-difluorophenyl)-2-(3,3-dimethyl-2-oxobutyl)sulfanylquinazolin-4-one
CID 2365295
3-[4-(1-cyclobutylpiperidin-4-yl)oxy-2-fluorophenyl]-2-methylquinazolin-4-one
CID 23151162
2-[3-(2,4-difluorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)acetamide
CID 16532181
2-methyl-3-(2-methyl-3-trimethylsilyloxyphenyl)quinazolin-4-one
CID 629564
3-(2,4-difluorophenyl)-2-[2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]sulfanylquinazolin-4-one
CID 41124096
2,5-difluoro-N-[4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]benzenesulfonamide
CID 16799885
2-(cyclohexylmethylsulfanyl)-3-(2,4-difluorophenyl)quinazolin-4-one
CID 7845486
2-[(4-aminoquinazolin-2-yl)methylsulfanyl]-3-(2,4-difluorophenyl)quinazolin-4-one
CID 27914582

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one?
The IUPAC name of 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one (CID 2824755) is 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one.
What is the SMILES notation for 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one?
The canonical SMILES for 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one is Cc1nc2ccccc2c(=O)n1-c1ccc(F)cc1F.
What is the InChIKey of 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one?
The InChIKey is HCJPLIMIYWMBRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N2O/c1-9-18-13-5-3-2-4-11(13)15(20)19(9)14-7-6-10(16)8-12(14)17/h2-8H,1H3.
What are the key properties of 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one?
3-(2,4-difluorophenyl)-2-methylquinazolin-4-one has a molecular weight of 272.25 g/mol, XLogP of 2.97, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-difluorophenyl)-2-methylquinazolin-4-one is sourced from PubChem (CID 2824755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).