3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine

C58H38N8 — CID 164780995

IUPAC3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine
SMILESc1ccc(-c2cc(-c3cc(-c4cc(-c5ccccc5)cc(-c5nc6ccccn6c5-c5ccccc5)n4)nc(-c4ccccc4)n3)nc(-c3nc4ccccn4c3-c3ccccc3)c2)cc1
InChIInChI=1S/C58H38N8/c1-6-20-39(21-7-1)44-34-46(59-50(36-44)54-56(41-24-10-3-11-25-41)65-32-18-16-30-52(65)63-54)48-38-49(62-58(61-48)43-28-14-5-15-29-43)47-35-45(40-22-8-2-9-23-40)37-51(60-47)55-57(42-26-12-4-13-27-42)66-33-19-17-31-53(66)64-55/h1-38H
InChIKeyBTWLKNGZIBICRB-UHFFFAOYSA-N
MW847.00 g/mol
LogP13.56
Rot. Bonds9

About 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine

3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine (PubChem CID 164780995) has the molecular formula C58H38N8 and a molecular weight of 847.00 g/mol. Its IUPAC name is 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine
PubChem CID164780995
Molecular FormulaC58H38N8
Molecular Weight847.00 g/mol
Exact Mass846.32
IUPAC Name3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine
SMILESc1ccc(-c2cc(-c3cc(-c4cc(-c5ccccc5)cc(-c5nc6ccccn6c5-c5ccccc5)n4)nc(-c4ccccc4)n3)nc(-c3nc4ccccn4c3-c3ccccc3)c2)cc1
InChIInChI=1S/C58H38N8/c1-6-20-39(21-7-1)44-34-46(59-50(36-44)54-56(41-24-10-3-11-25-41)65-32-18-16-30-52(65)63-54)48-38-49(62-58(61-48)43-28-14-5-15-29-43)47-35-45(40-22-8-2-9-23-40)37-51(60-47)55-57(42-26-12-4-13-27-42)66-33-19-17-31-53(66)64-55/h1-38H
InChIKeyBTWLKNGZIBICRB-UHFFFAOYSA-N
XLogP13.56
TPSA86.16 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500847.00
LogP ≤ 513.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine with MolForge

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Related Compounds

3-phenyl-2-[4-phenyl-6-[4-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]imidazo[1,2-a]pyridine
CID 155307009
2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine
CID 168835931
bis(3-[4-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]-2-naphthalen-2-ylimidazo[1,2-a]pyridine);3-[4-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine
CID 159888199
2-phenyl-3-[3-[2-phenyl-6-[3-(2-phenylimidazo[1,2-a]pyridin-3-yl)phenyl]pyrimidin-4-yl]phenyl]imidazo[1,2-a]pyridine
CID 155306963
3-phenyl-2-[3-[3-phenyl-5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]imidazo[1,2-a]pyridine
CID 164781284
2-(4-phenylphenyl)-3-[3-[4-phenyl-6-[3-[2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]-2-pyridinyl]phenyl]imidazo[1,2-a]pyridine
CID 164781069
3-phenyl-2-[3-[4-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]imidazo[1,2-a]pyridine
CID 168835790
2-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-naphthalen-1-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine
CID 164781104
N-phenyl-N-[4-(2-phenylimidazo[1,2-a]pyridin-3-yl)phenyl]-4-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]aniline
CID 167376610
5-phenyl-2-[4-phenyl-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]phenol
CID 169318160
2-[3-[3-deuterio-5-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-phenyl-3-[3-[3-phenyl-5-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]phenyl]quinoxaline
CID 165059818
2-phenyl-3-[3-[3-phenyl-5-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]phenyl]quinoxaline
CID 164781299

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine?
The IUPAC name of 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine (CID 164780995) is 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine is c1ccc(-c2cc(-c3cc(-c4cc(-c5ccccc5)cc(-c5nc6ccccn6c5-c5ccccc5)n4)nc(-c4ccccc4)n3)nc(-c3nc4ccccn4c3-c3ccccc3)c2)cc1.
What is the InChIKey of 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine?
The InChIKey is BTWLKNGZIBICRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H38N8/c1-6-20-39(21-7-1)44-34-46(59-50(36-44)54-56(41-24-10-3-11-25-41)65-32-18-16-30-52(65)63-54)48-38-49(62-58(61-48)43-28-14-5-15-29-43)47-35-45(40-22-8-2-9-23-40)37-51(60-47)55-57(42-26-12-4-13-27-42)66-33-19-17-31-53(66)64-55/h1-38H.
What are the key properties of 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine?
3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine has a molecular weight of 847.00 g/mol, XLogP of 13.56, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-2-[4-phenyl-6-[2-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]pyrimidin-4-yl]-2-pyridinyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 164780995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).