4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol

C32H22N4O2 — CID 136661911

IUPAC4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol
SMILESOc1ccc(-c2cc(-c3ccccn3)nc(-c3cc(-c4ccc(O)cc4)cc(-c4ccccn4)n3)c2)cc1
InChIInChI=1S/C32H22N4O2/c37-25-11-7-21(8-12-25)23-17-29(27-5-1-3-15-33-27)35-31(19-23)32-20-24(22-9-13-26(38)14-10-22)18-30(36-32)28-6-2-4-16-34-28/h1-20,37-38H
InChIKeyNIOSRPPZOFJULX-UHFFFAOYSA-N
MW494.55 g/mol
LogP7.01
Rot. Bonds5

About 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol

4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol (PubChem CID 136661911) has the molecular formula C32H22N4O2 and a molecular weight of 494.55 g/mol. Its IUPAC name is 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol.

Molecular Properties

Compound Name4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol
PubChem CID136661911
Molecular FormulaC32H22N4O2
Molecular Weight494.55 g/mol
Exact Mass494.17
IUPAC Name4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol
SMILESOc1ccc(-c2cc(-c3ccccn3)nc(-c3cc(-c4ccc(O)cc4)cc(-c4ccccn4)n3)c2)cc1
InChIInChI=1S/C32H22N4O2/c37-25-11-7-21(8-12-25)23-17-29(27-5-1-3-15-33-27)35-31(19-23)32-20-24(22-9-13-26(38)14-10-22)18-30(36-32)28-6-2-4-16-34-28/h1-20,37-38H
InChIKeyNIOSRPPZOFJULX-UHFFFAOYSA-N
XLogP7.01
TPSA92.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.55
LogP ≤ 57.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol with MolForge

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Launch Full Analysis

Related Compounds

4-[4-[2-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122364716
2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-[2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-pyridinyl]pyridine
CID 15448140
4-(4-chlorophenyl)-2,6-dipyridin-2-ylpyridine
CID 10871645
4-[2-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122364714
ethane;4-(4-methylphenyl)-2,6-dipyridin-2-ylpyridine
CID 142185712
4-phenyl-2-[6-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-6-pyridin-2-ylpyridine
CID 15788654
[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]methanol
CID 71437815
4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine
CID 158535696
2-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)benzene-1,3-diol
CID 136711024
4-[3-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 102048585
chloroplatinum(1+);4-(4-methylphenyl)-2,6-dipyridin-2-ylpyridine;chloride
CID 165430889
4-[10-(2,6-dipyridin-2-yl-4-pyridinyl)anthracen-9-yl]-2,6-dipyridin-2-ylpyridine;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-2,6-dipyridin-2-ylpyridine;2,4,6-tripyridin-2-ylpyridine
CID 161380228

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol?
The IUPAC name of 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol (CID 136661911) is 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol.
What is the SMILES notation for 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol?
The canonical SMILES for 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol is Oc1ccc(-c2cc(-c3ccccn3)nc(-c3cc(-c4ccc(O)cc4)cc(-c4ccccn4)n3)c2)cc1.
What is the InChIKey of 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol?
The InChIKey is NIOSRPPZOFJULX-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H22N4O2/c37-25-11-7-21(8-12-25)23-17-29(27-5-1-3-15-33-27)35-31(19-23)32-20-24(22-9-13-26(38)14-10-22)18-30(36-32)28-6-2-4-16-34-28/h1-20,37-38H.
What are the key properties of 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol?
4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol has a molecular weight of 494.55 g/mol, XLogP of 7.01, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(4-hydroxyphenyl)-6-pyridin-2-yl-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]phenol is sourced from PubChem (CID 136661911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).