2-(4-phenylphenyl)benzo[f]quinoxaline

C24H16N2 — CID 164807898

IUPAC2-(4-phenylphenyl)benzo[f]quinoxaline
SMILESc1ccc(-c2ccc(-c3cnc4ccc5ccccc5c4n3)cc2)cc1
InChIInChI=1S/C24H16N2/c1-2-6-17(7-3-1)18-10-12-20(13-11-18)23-16-25-22-15-14-19-8-4-5-9-21(19)24(22)26-23/h1-16H
InChIKeyVPCZYPUBXSCLSR-UHFFFAOYSA-N
MW332.41 g/mol
LogP6.12
Rot. Bonds2

About 2-(4-phenylphenyl)benzo[f]quinoxaline

2-(4-phenylphenyl)benzo[f]quinoxaline (PubChem CID 164807898) has the molecular formula C24H16N2 and a molecular weight of 332.41 g/mol. Its IUPAC name is 2-(4-phenylphenyl)benzo[f]quinoxaline.

Molecular Properties

Compound Name2-(4-phenylphenyl)benzo[f]quinoxaline
PubChem CID164807898
Molecular FormulaC24H16N2
Molecular Weight332.41 g/mol
Exact Mass332.13
IUPAC Name2-(4-phenylphenyl)benzo[f]quinoxaline
SMILESc1ccc(-c2ccc(-c3cnc4ccc5ccccc5c4n3)cc2)cc1
InChIInChI=1S/C24H16N2/c1-2-6-17(7-3-1)18-10-12-20(13-11-18)23-16-25-22-15-14-19-8-4-5-9-21(19)24(22)26-23/h1-16H
InChIKeyVPCZYPUBXSCLSR-UHFFFAOYSA-N
XLogP6.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.41
LogP ≤ 56.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

iridium;2-phenylbenzo[h]quinoline
CID 175438986
2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]benzo[h]quinoline
CID 129265511
2,13-diazapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaene
CID 9184
2-tert-butylbenzo[f]quinoxaline
CID 164810163
N,N-bis(4-benzo[h][1,5]naphthyridin-2-ylphenyl)-7-naphthalen-2-ylphenanthren-2-amine
CID 170404506
2-[7-[7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-2-yl]quinolin-2-yl]benzo[h]quinoline;2-[7-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-2-yl]quinolin-2-yl]benzo[h]quinoline
CID 165009451
1-phenyl-3-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]benzo[f]quinoline
CID 146185311
4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-3,6,9,12,15,18-hexazatetracyclo[12.4.0.02,7.08,13]octadeca-1(18),2,4,6,8,10,12,14,16-nonaene
CID 155765285
2-(naphthalen-1-ylmethyl)benzo[f]quinoxaline
CID 158138493
6-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]benzo[c]phenanthridine
CID 155792510
6-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]benzo[c]phenanthridine
CID 155792781
2,3-diphenyl-5-(4-phenylphenyl)pyrazine
CID 58991364

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)benzo[f]quinoxaline?
The IUPAC name of 2-(4-phenylphenyl)benzo[f]quinoxaline (CID 164807898) is 2-(4-phenylphenyl)benzo[f]quinoxaline.
What is the SMILES notation for 2-(4-phenylphenyl)benzo[f]quinoxaline?
The canonical SMILES for 2-(4-phenylphenyl)benzo[f]quinoxaline is c1ccc(-c2ccc(-c3cnc4ccc5ccccc5c4n3)cc2)cc1.
What is the InChIKey of 2-(4-phenylphenyl)benzo[f]quinoxaline?
The InChIKey is VPCZYPUBXSCLSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N2/c1-2-6-17(7-3-1)18-10-12-20(13-11-18)23-16-25-22-15-14-19-8-4-5-9-21(19)24(22)26-23/h1-16H.
What are the key properties of 2-(4-phenylphenyl)benzo[f]quinoxaline?
2-(4-phenylphenyl)benzo[f]quinoxaline has a molecular weight of 332.41 g/mol, XLogP of 6.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)benzo[f]quinoxaline is sourced from PubChem (CID 164807898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).