2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine

C30H20N2O — CID 156552837

IUPAC2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine
SMILESc1ccc(-c2cncc(-c3oc(-c4ccccc4-c4ccccc4)c4ccccc34)n2)cc1
InChIInChI=1S/C30H20N2O/c1-3-11-21(12-4-1)23-15-7-8-16-24(23)29-25-17-9-10-18-26(25)30(33-29)28-20-31-19-27(32-28)22-13-5-2-6-14-22/h1-20H
InChIKeySJHPIZZAJCXUSP-UHFFFAOYSA-N
MW424.50 g/mol
LogP7.89
Rot. Bonds4

About 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine

2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine (PubChem CID 156552837) has the molecular formula C30H20N2O and a molecular weight of 424.50 g/mol. Its IUPAC name is 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine.

Molecular Properties

Compound Name2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine
PubChem CID156552837
Molecular FormulaC30H20N2O
Molecular Weight424.50 g/mol
Exact Mass424.16
IUPAC Name2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine
SMILESc1ccc(-c2cncc(-c3oc(-c4ccccc4-c4ccccc4)c4ccccc34)n2)cc1
InChIInChI=1S/C30H20N2O/c1-3-11-21(12-4-1)23-15-7-8-16-24(23)29-25-17-9-10-18-26(25)30(33-29)28-20-31-19-27(32-28)22-13-5-2-6-14-22/h1-20H
InChIKeySJHPIZZAJCXUSP-UHFFFAOYSA-N
XLogP7.89
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.50
LogP ≤ 57.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-5-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyridine
CID 156552863
2-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyridine
CID 156552730
1-(2,6-diphenylphenyl)-3-(2-phenylphenyl)-2-benzofuran
CID 156553154
2-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]-1,3,5-triazine
CID 156553182
1-phenanthren-4-yl-3-(2-phenylphenyl)-2-benzofuran
CID 156553333
2-(2,3-dichlorophenyl)-6-phenylpyrazine
CID 68675412
1-[3-(2-phenylphenyl)-2-benzofuran-1-yl]dibenzofuran
CID 156553354
1-(2-phenyl-1-benzofuran-3-yl)-3-(2-phenylphenyl)-2-benzofuran
CID 156552693
3,5-diphenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyridine;2-phenyl-3-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyridine;3-phenyl-2-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyridine;3-phenyl-4-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyridine;4-phenyl-3-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyridine
CID 159554820
2-methyl-6-(2-phenylphenyl)pyrazine
CID 58969440
2-phenyl-1-[3-(2-phenylphenyl)-2-benzofuran-1-yl]indolizine
CID 156552702
2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine
CID 171761185

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine?
The IUPAC name of 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine (CID 156552837) is 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine.
What is the SMILES notation for 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine?
The canonical SMILES for 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine is c1ccc(-c2cncc(-c3oc(-c4ccccc4-c4ccccc4)c4ccccc34)n2)cc1.
What is the InChIKey of 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine?
The InChIKey is SJHPIZZAJCXUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20N2O/c1-3-11-21(12-4-1)23-15-7-8-16-24(23)29-25-17-9-10-18-26(25)30(33-29)28-20-31-19-27(32-28)22-13-5-2-6-14-22/h1-20H.
What are the key properties of 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine?
2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine has a molecular weight of 424.50 g/mol, XLogP of 7.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-[3-(2-phenylphenyl)-2-benzofuran-1-yl]pyrazine is sourced from PubChem (CID 156552837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).