2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole

C34H22N6O — CID 143438639

IUPAC2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole
SMILESc1ccc(-c2cc(-c3ccccn3)nc(-c3nnc(-c4cc(-c5ccccc5)cc(-c5ccccn5)n4)o3)c2)cc1
InChIInChI=1S/C34H22N6O/c1-3-11-23(12-4-1)25-19-29(27-15-7-9-17-35-27)37-31(21-25)33-39-40-34(41-33)32-22-26(24-13-5-2-6-14-24)20-30(38-32)28-16-8-10-18-36-28/h1-22H
InChIKeyWRHSIJSCSMMEHB-UHFFFAOYSA-N
MW530.59 g/mol
LogP7.65
Rot. Bonds6

About 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole

2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole (PubChem CID 143438639) has the molecular formula C34H22N6O and a molecular weight of 530.59 g/mol. Its IUPAC name is 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole
PubChem CID143438639
Molecular FormulaC34H22N6O
Molecular Weight530.59 g/mol
Exact Mass530.19
IUPAC Name2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole
SMILESc1ccc(-c2cc(-c3ccccn3)nc(-c3nnc(-c4cc(-c5ccccc5)cc(-c5ccccn5)n4)o3)c2)cc1
InChIInChI=1S/C34H22N6O/c1-3-11-23(12-4-1)25-19-29(27-15-7-9-17-35-27)37-31(21-25)33-39-40-34(41-33)32-22-26(24-13-5-2-6-14-24)20-30(38-32)28-16-8-10-18-36-28/h1-22H
InChIKeyWRHSIJSCSMMEHB-UHFFFAOYSA-N
XLogP7.65
TPSA90.48 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.59
LogP ≤ 57.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole with MolForge

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Launch Full Analysis

Related Compounds

4-phenyl-2-[6-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-6-pyridin-2-ylpyridine
CID 15788654
2-(6-pyridin-2-yl-2-pyridinyl)-5-[6-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-1,3,4-oxadiazole
CID 59514881
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
4-[3-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 102048585
2-(6-pyridin-2-yl-2-pyridinyl)-5-[4-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 59236802
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-(3,5-dipyridin-2-ylphenyl)-2-phenyl-6-pyridin-2-ylpyridine
CID 23528039
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 126730884
2-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)benzene-1,3-diol
CID 136711024
4-[4-[2-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122364716
2-[3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-5-pyridin-2-ylphenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 126730883
4-[4-(12-phenylchrysen-6-yl)phenyl]-2,6-dipyridin-2-ylpyridine
CID 155655346

Frequently Asked Questions

What is the IUPAC name of 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole?
The IUPAC name of 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole (CID 143438639) is 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole?
The canonical SMILES for 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole is c1ccc(-c2cc(-c3ccccn3)nc(-c3nnc(-c4cc(-c5ccccc5)cc(-c5ccccn5)n4)o3)c2)cc1.
What is the InChIKey of 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole?
The InChIKey is WRHSIJSCSMMEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22N6O/c1-3-11-23(12-4-1)25-19-29(27-15-7-9-17-35-27)37-31(21-25)33-39-40-34(41-33)32-22-26(24-13-5-2-6-14-24)20-30(38-32)28-16-8-10-18-36-28/h1-22H.
What are the key properties of 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole?
2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole has a molecular weight of 530.59 g/mol, XLogP of 7.65, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazole is sourced from PubChem (CID 143438639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).