1-(4-chlorophenyl)-2-phenylquinolin-4-one

C21H14ClNO — CID 102287989

IUPAC1-(4-chlorophenyl)-2-phenylquinolin-4-one
SMILESO=c1cc(-c2ccccc2)n(-c2ccc(Cl)cc2)c2ccccc12
InChIInChI=1S/C21H14ClNO/c22-16-10-12-17(13-11-16)23-19-9-5-4-8-18(19)21(24)14-20(23)15-6-2-1-3-7-15/h1-14H
InChIKeyQSEJMZDRQQHOSS-UHFFFAOYSA-N
MW331.80 g/mol
LogP5.31
Rot. Bonds2

About 1-(4-chlorophenyl)-2-phenylquinolin-4-one

1-(4-chlorophenyl)-2-phenylquinolin-4-one (PubChem CID 102287989) has the molecular formula C21H14ClNO and a molecular weight of 331.80 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-phenylquinolin-4-one.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-phenylquinolin-4-one
PubChem CID102287989
Molecular FormulaC21H14ClNO
Molecular Weight331.80 g/mol
Exact Mass331.08
IUPAC Name1-(4-chlorophenyl)-2-phenylquinolin-4-one
SMILESO=c1cc(-c2ccccc2)n(-c2ccc(Cl)cc2)c2ccccc12
InChIInChI=1S/C21H14ClNO/c22-16-10-12-17(13-11-16)23-19-9-5-4-8-18(19)21(24)14-20(23)15-6-2-1-3-7-15/h1-14H
InChIKeyQSEJMZDRQQHOSS-UHFFFAOYSA-N
XLogP5.31
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.80
LogP ≤ 55.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(4-chlorophenyl)-2-phenylquinolin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-chlorophenyl)-1-phenylquinolin-4-one
CID 102171684
4-(4-oxo-2-phenylquinolin-1-yl)benzonitrile
CID 102287988
1-(4-nitrophenyl)-2-phenylquinolin-4-one
CID 44632197
1-(2-tert-butylphenyl)-2-(4-chlorophenyl)quinolin-4-one
CID 102439993
3-(4-chlorophenyl)-9-phenylcarbazole
CID 59365524
1-tert-butyl-2-phenylquinolin-4-one
CID 166440287
1,2,6-triphenylpyridin-4-one
CID 13088641
2-(4-chlorophenyl)-1,5-diphenylpyrrole
CID 12741718
9-(4-chlorophenyl)-2-fluorocarbazole
CID 169073574
4-[3-(4-chlorophenyl)-5-phenylphenyl]-9-phenylcarbazole
CID 176878196
9-[4-[3-(3,5-diphenylphenyl)phenyl]phenyl]carbazole
CID 118595106
3-carbazol-9-yl-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 149208011

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-phenylquinolin-4-one?
The IUPAC name of 1-(4-chlorophenyl)-2-phenylquinolin-4-one (CID 102287989) is 1-(4-chlorophenyl)-2-phenylquinolin-4-one.
What is the SMILES notation for 1-(4-chlorophenyl)-2-phenylquinolin-4-one?
The canonical SMILES for 1-(4-chlorophenyl)-2-phenylquinolin-4-one is O=c1cc(-c2ccccc2)n(-c2ccc(Cl)cc2)c2ccccc12.
What is the InChIKey of 1-(4-chlorophenyl)-2-phenylquinolin-4-one?
The InChIKey is QSEJMZDRQQHOSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14ClNO/c22-16-10-12-17(13-11-16)23-19-9-5-4-8-18(19)21(24)14-20(23)15-6-2-1-3-7-15/h1-14H.
What are the key properties of 1-(4-chlorophenyl)-2-phenylquinolin-4-one?
1-(4-chlorophenyl)-2-phenylquinolin-4-one has a molecular weight of 331.80 g/mol, XLogP of 5.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-phenylquinolin-4-one is sourced from PubChem (CID 102287989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).