4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine

C38H24N4 — CID 166504132

IUPAC4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine
SMILESc1ccc2c(c1)c1cc(-c3cc(-c4ccncc4)ccn3)ccc1c1ccc(-c3cc(-c4ccncc4)ccn3)cc21
InChIInChI=1S/C38H24N4/c1-2-4-32-31(3-1)35-21-29(37-23-27(13-19-41-37)25-9-15-39-16-10-25)5-7-33(35)34-8-6-30(22-36(32)34)38-24-28(14-20-42-38)26-11-17-40-18-12-26/h1-24H
InChIKeySDHGILIZDAVHCE-UHFFFAOYSA-N
MW536.64 g/mol
LogP9.39
Rot. Bonds4

About 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine

4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine (PubChem CID 166504132) has the molecular formula C38H24N4 and a molecular weight of 536.64 g/mol. Its IUPAC name is 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine.

Molecular Properties

Compound Name4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine
PubChem CID166504132
Molecular FormulaC38H24N4
Molecular Weight536.64 g/mol
Exact Mass536.20
IUPAC Name4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine
SMILESc1ccc2c(c1)c1cc(-c3cc(-c4ccncc4)ccn3)ccc1c1ccc(-c3cc(-c4ccncc4)ccn3)cc21
InChIInChI=1S/C38H24N4/c1-2-4-32-31(3-1)35-21-29(37-23-27(13-19-41-37)25-9-15-39-16-10-25)5-7-33(35)34-8-6-30(22-36(32)34)38-24-28(14-20-42-38)26-11-17-40-18-12-26/h1-24H
InChIKeySDHGILIZDAVHCE-UHFFFAOYSA-N
XLogP9.39
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.64
LogP ≤ 59.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-phenyl-4-triphenylen-2-ylpyridine
CID 168743611
2-(9,10-diphenylanthracen-2-yl)-4-phenylpyridine
CID 59722107
4-[3-pyridin-4-yl-5-(4-triphenylen-2-ylnaphthalen-1-yl)phenyl]pyridine
CID 118583054
4-(9,10-diphenylanthracen-2-yl)-2-phenylpyridine
CID 59722046
4-phenyl-2-(3-phenylphenyl)pyridine
CID 58028222
8-[2-[6-(3-quinolin-8-ylphenyl)triphenylen-2-yl]-4-pyridinyl]quinoline
CID 167027860
4-(4-hexacyclo[24.4.0.02,7.08,13.014,19.020,25]triaconta-1(30),2(7),3,5,8,10,12,14,16,18,20,22,24,26,28-pentadecaenyl)-2-phenyl-6-pyridin-4-ylpyrimidine
CID 130267857
4-(3-phenylphenyl)-6-triphenylen-2-ylpyrimidine
CID 137389670
2-phenyl-4-(4-phenylphenyl)-6-[7-(5-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]-1,3,5-triazine
CID 134380984
2-pyridin-4-yl-4-[10-(4-pyridin-2-ylphenyl)anthracen-9-yl]pyridine
CID 153170938
4-phenyl-2-(7-phenyldibenzothiophen-2-yl)pyridine
CID 166574154
4-[10-[4-(3,10-diphenylanthracen-9-yl)phenyl]anthracen-9-yl]pyridine
CID 89025356

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine?
The IUPAC name of 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine (CID 166504132) is 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine.
What is the SMILES notation for 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine?
The canonical SMILES for 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine is c1ccc2c(c1)c1cc(-c3cc(-c4ccncc4)ccn3)ccc1c1ccc(-c3cc(-c4ccncc4)ccn3)cc21.
What is the InChIKey of 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine?
The InChIKey is SDHGILIZDAVHCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H24N4/c1-2-4-32-31(3-1)35-21-29(37-23-27(13-19-41-37)25-9-15-39-16-10-25)5-7-33(35)34-8-6-30(22-36(32)34)38-24-28(14-20-42-38)26-11-17-40-18-12-26/h1-24H.
What are the key properties of 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine?
4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine has a molecular weight of 536.64 g/mol, XLogP of 9.39, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-4-yl-2-[7-(4-pyridin-4-yl-2-pyridinyl)triphenylen-2-yl]pyridine is sourced from PubChem (CID 166504132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).