11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline

C18H8F2N4 — CID 78350446

IUPAC11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline
SMILESFc1cc2nc3c4cccnc4c4ncccc4c3nc2cc1F
InChIInChI=1S/C18H8F2N4/c19-11-7-13-14(8-12(11)20)24-18-10-4-2-6-22-16(10)15-9(17(18)23-13)3-1-5-21-15/h1-8H
InChIKeyJPYSVTAPJARFNM-UHFFFAOYSA-N
MW318.29 g/mol
LogP4.16
Rot. Bonds

About 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline

11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline (PubChem CID 78350446) has the molecular formula C18H8F2N4 and a molecular weight of 318.29 g/mol. Its IUPAC name is 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline.

Molecular Properties

Compound Name11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline
PubChem CID78350446
Molecular FormulaC18H8F2N4
Molecular Weight318.29 g/mol
Exact Mass318.07
IUPAC Name11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline
SMILESFc1cc2nc3c4cccnc4c4ncccc4c3nc2cc1F
InChIInChI=1S/C18H8F2N4/c19-11-7-13-14(8-12(11)20)24-18-10-4-2-6-22-16(10)15-9(17(18)23-13)3-1-5-21-15/h1-8H
InChIKeyJPYSVTAPJARFNM-UHFFFAOYSA-N
XLogP4.16
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.29
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline 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 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline?
The IUPAC name of 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline (CID 78350446) is 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline.
What is the SMILES notation for 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline?
The canonical SMILES for 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline is Fc1cc2nc3c4cccnc4c4ncccc4c3nc2cc1F.
What is the InChIKey of 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline?
The InChIKey is JPYSVTAPJARFNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H8F2N4/c19-11-7-13-14(8-12(11)20)24-18-10-4-2-6-22-16(10)15-9(17(18)23-13)3-1-5-21-15/h1-8H.
What are the key properties of 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline?
11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline has a molecular weight of 318.29 g/mol, XLogP of 4.16, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 11,12-difluoroquinoxalino[2,3-f][1,10]phenanthroline is sourced from PubChem (CID 78350446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).