4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one

C14H10ClFN2O — CID 79291737

IUPAC4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one
SMILESO=C1CN(c2ccc(Cl)cc2)c2ccc(F)cc2N1
InChIInChI=1S/C14H10ClFN2O/c15-9-1-4-11(5-2-9)18-8-14(19)17-12-7-10(16)3-6-13(12)18/h1-7H,8H2,(H,17,19)
InChIKeyJLUODRFWFRYURQ-UHFFFAOYSA-N
MW276.70 g/mol
LogP3.57
Rot. Bonds1

About 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one

4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one (PubChem CID 79291737) has the molecular formula C14H10ClFN2O and a molecular weight of 276.70 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one
PubChem CID79291737
Molecular FormulaC14H10ClFN2O
Molecular Weight276.70 g/mol
Exact Mass276.05
IUPAC Name4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one
SMILESO=C1CN(c2ccc(Cl)cc2)c2ccc(F)cc2N1
InChIInChI=1S/C14H10ClFN2O/c15-9-1-4-11(5-2-9)18-8-14(19)17-12-7-10(16)3-6-13(12)18/h1-7H,8H2,(H,17,19)
InChIKeyJLUODRFWFRYURQ-UHFFFAOYSA-N
XLogP3.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.70
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one?
The IUPAC name of 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one (CID 79291737) is 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one.
What is the SMILES notation for 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one?
The canonical SMILES for 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one is O=C1CN(c2ccc(Cl)cc2)c2ccc(F)cc2N1.
What is the InChIKey of 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one?
The InChIKey is JLUODRFWFRYURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFN2O/c15-9-1-4-11(5-2-9)18-8-14(19)17-12-7-10(16)3-6-13(12)18/h1-7H,8H2,(H,17,19).
What are the key properties of 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one?
4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one has a molecular weight of 276.70 g/mol, XLogP of 3.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-7-fluoro-1,3-dihydroquinoxalin-2-one is sourced from PubChem (CID 79291737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).