2,3-diphenyl-5-(4-phenylphenyl)pyrazine

C28H20N2 — CID 58991364

IUPAC2,3-diphenyl-5-(4-phenylphenyl)pyrazine
SMILESc1ccc(-c2ccc(-c3cnc(-c4ccccc4)c(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C28H20N2/c1-4-10-21(11-5-1)22-16-18-23(19-17-22)26-20-29-27(24-12-6-2-7-13-24)28(30-26)25-14-8-3-9-15-25/h1-20H
InChIKeyCSKSXFKZFXMERK-UHFFFAOYSA-N
MW384.48 g/mol
LogP7.14
Rot. Bonds4

About 2,3-diphenyl-5-(4-phenylphenyl)pyrazine

2,3-diphenyl-5-(4-phenylphenyl)pyrazine (PubChem CID 58991364) has the molecular formula C28H20N2 and a molecular weight of 384.48 g/mol. Its IUPAC name is 2,3-diphenyl-5-(4-phenylphenyl)pyrazine.

Molecular Properties

Compound Name2,3-diphenyl-5-(4-phenylphenyl)pyrazine
PubChem CID58991364
Molecular FormulaC28H20N2
Molecular Weight384.48 g/mol
Exact Mass384.16
IUPAC Name2,3-diphenyl-5-(4-phenylphenyl)pyrazine
SMILESc1ccc(-c2ccc(-c3cnc(-c4ccccc4)c(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C28H20N2/c1-4-10-21(11-5-1)22-16-18-23(19-17-22)26-20-29-27(24-12-6-2-7-13-24)28(30-26)25-14-8-3-9-15-25/h1-20H
InChIKeyCSKSXFKZFXMERK-UHFFFAOYSA-N
XLogP7.14
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 57.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-diphenyl-5-[4-(trifluoromethyl)phenyl]pyrazine
CID 59806456
2,3-bis(3,5-dimethylphenyl)-5-(4-phenylphenyl)pyrazine
CID 118103502
3-(5,6-diphenylpyrazin-2-yl)benzonitrile
CID 66672885
2,3,5-triphenyl-6-[4-(3,5,6-triphenylpyrazin-2-yl)phenyl]pyrazine
CID 139681938
5-[4-[4-(6-hexacyclo[12.10.2.02,7.08,13.018,26.021,25]hexacosa-1(24),2(7),3,5,8,10,12,14,16,18(26),19,21(25),22-tridecaenyl)naphthalen-1-yl]phenyl]-2,3-diphenylpyrazine
CID 167410449
3,5-diphenyl-2-spiro[benzo[b]fluorene-11,9'-fluorene]-2'-ylpyrazine
CID 129264516
2-methoxy-3,5-diphenylpyrazine
CID 13123633
2-(2-methylphenyl)-3-phenyl-5-(3-phenylphenyl)pyrazine
CID 118267385
5-[4-[4-(16-hexacyclo[12.10.2.02,7.08,13.018,26.021,25]hexacosa-1(24),2,4,6,8,10,12,14(26),15,17,19,21(25),22-tridecaenyl)naphthalen-1-yl]phenyl]-2,3-diphenylpyrazine
CID 167410999
3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 159278418
1-(3,6-diphenylpyrazin-2-yl)ethanone
CID 15500396
5-[4-[6-[5-(5-methylphenanthren-4-yl)phenanthren-2-yl]naphthalen-2-yl]phenyl]-2,3-diphenylpyrazine
CID 167411991

Frequently Asked Questions

What is the IUPAC name of 2,3-diphenyl-5-(4-phenylphenyl)pyrazine?
The IUPAC name of 2,3-diphenyl-5-(4-phenylphenyl)pyrazine (CID 58991364) is 2,3-diphenyl-5-(4-phenylphenyl)pyrazine.
What is the SMILES notation for 2,3-diphenyl-5-(4-phenylphenyl)pyrazine?
The canonical SMILES for 2,3-diphenyl-5-(4-phenylphenyl)pyrazine is c1ccc(-c2ccc(-c3cnc(-c4ccccc4)c(-c4ccccc4)n3)cc2)cc1.
What is the InChIKey of 2,3-diphenyl-5-(4-phenylphenyl)pyrazine?
The InChIKey is CSKSXFKZFXMERK-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20N2/c1-4-10-21(11-5-1)22-16-18-23(19-17-22)26-20-29-27(24-12-6-2-7-13-24)28(30-26)25-14-8-3-9-15-25/h1-20H.
What are the key properties of 2,3-diphenyl-5-(4-phenylphenyl)pyrazine?
2,3-diphenyl-5-(4-phenylphenyl)pyrazine has a molecular weight of 384.48 g/mol, XLogP of 7.14, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenyl-5-(4-phenylphenyl)pyrazine is sourced from PubChem (CID 58991364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).