2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine

C28H18N2OS — CID 140818943

IUPAC2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine
SMILESc1ccc(Oc2cc(-c3ccccn3)ccc2-c2ccc3sc4ccccc4c3c2)nc1
InChIInChI=1S/C28H18N2OS/c1-2-9-26-22(7-1)23-17-19(12-14-27(23)32-26)21-13-11-20(24-8-3-5-15-29-24)18-25(21)31-28-10-4-6-16-30-28/h1-18H
InChIKeyZUSSCRHAXRDFOB-UHFFFAOYSA-N
MW430.53 g/mol
LogP7.97
Rot. Bonds4

About 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine

2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine (PubChem CID 140818943) has the molecular formula C28H18N2OS and a molecular weight of 430.53 g/mol. Its IUPAC name is 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine.

Molecular Properties

Compound Name2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine
PubChem CID140818943
Molecular FormulaC28H18N2OS
Molecular Weight430.53 g/mol
Exact Mass430.11
IUPAC Name2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine
SMILESc1ccc(Oc2cc(-c3ccccn3)ccc2-c2ccc3sc4ccccc4c3c2)nc1
InChIInChI=1S/C28H18N2OS/c1-2-9-26-22(7-1)23-17-19(12-14-27(23)32-26)21-13-11-20(24-8-3-5-15-29-24)18-25(21)31-28-10-4-6-16-30-28/h1-18H
InChIKeyZUSSCRHAXRDFOB-UHFFFAOYSA-N
XLogP7.97
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.53
LogP ≤ 57.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-dibenzothiophen-2-yl-6-phenyl-2-(3-pyridin-2-ylphenyl)pyrimidine
CID 130262859
4-[3,5-di(dibenzothiophen-2-yl)phenyl]-6-phenyl-2-(3-pyridin-2-ylphenyl)pyrimidine
CID 130263179
2-[7-(4-fluorophenyl)dibenzothiophen-2-yl]pyridine
CID 166576691
2-[2-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-5-pyridin-2-ylphenoxy]-6-pyridin-2-ylpyridine
CID 156674137
3-(7-pyridin-2-yldibenzothiophen-2-yl)-5-[2-(3-pyridin-2-ylphenyl)phenyl]pyridine
CID 140814604
4-(8-dibenzothiophen-3-yldibenzothiophen-2-yl)-N-phenyl-N-(4-pyridin-2-ylphenyl)aniline
CID 90076240
4-[8-(3-dibenzothiophen-4-ylphenyl)dibenzothiophen-2-yl]-N-phenyl-N-(4-pyridin-2-ylphenyl)aniline
CID 90076336
4-(4-dibenzothiophen-2-yldibenzofuran-1-yl)-2-phenyl-6-(2-pyridin-2-ylphenyl)pyrimidine
CID 155078082
(2-dibenzothiophen-2-yl-4-pyridinyl)-trimethylsilane
CID 140719910
tris(chloroplatinum(1+));2-(2-dibenzofuran-3-yl-5-pyridin-2-ylbenzene-6-id-1-yl)oxypyridine;2-(2-dibenzothiophen-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)oxypyridine;2-[2-(2,6-dimethyl-4-phenylphenyl)-5-pyridin-2-ylbenzene-6-id-1-yl]oxypyridine
CID 158452911
2-(3-dibenzothiophen-2-yl-5-pyridin-2-ylphenyl)-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine
CID 130210535
2-[3,5-di(dibenzothiophen-2-yl)phenyl]-4-phenyl-6-(2-pyridin-2-ylphenyl)pyrimidine
CID 130263187

Frequently Asked Questions

What is the IUPAC name of 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine?
The IUPAC name of 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine (CID 140818943) is 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine.
What is the SMILES notation for 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine?
The canonical SMILES for 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine is c1ccc(Oc2cc(-c3ccccn3)ccc2-c2ccc3sc4ccccc4c3c2)nc1.
What is the InChIKey of 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine?
The InChIKey is ZUSSCRHAXRDFOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H18N2OS/c1-2-9-26-22(7-1)23-17-19(12-14-27(23)32-26)21-13-11-20(24-8-3-5-15-29-24)18-25(21)31-28-10-4-6-16-30-28/h1-18H.
What are the key properties of 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine?
2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine has a molecular weight of 430.53 g/mol, XLogP of 7.97, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-dibenzothiophen-2-yl-3-pyridin-2-yloxyphenyl)pyridine is sourced from PubChem (CID 140818943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).