4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran

C26H20O2 — CID 5074511

IUPAC4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran
SMILESCOc1ccc(C=C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)cc1
InChIInChI=1S/C26H20O2/c1-27-24-16-14-20(15-17-24)12-13-21-18-25(22-8-4-2-5-9-22)28-26(19-21)23-10-6-3-7-11-23/h2-12,14-19H,1H3
InChIKeyWZBARJGXQUJNDD-UHFFFAOYSA-N
MW364.44 g/mol
LogP6.35
Rot. Bonds4

About 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran

4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran (PubChem CID 5074511) has the molecular formula C26H20O2 and a molecular weight of 364.44 g/mol. Its IUPAC name is 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran.

Molecular Properties

Compound Name4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran
PubChem CID5074511
Molecular FormulaC26H20O2
Molecular Weight364.44 g/mol
Exact Mass364.15
IUPAC Name4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran
SMILESCOc1ccc(C=C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)cc1
InChIInChI=1S/C26H20O2/c1-27-24-16-14-20(15-17-24)12-13-21-18-25(22-8-4-2-5-9-22)28-26(19-21)23-10-6-3-7-11-23/h2-12,14-19H,1H3
InChIKeyWZBARJGXQUJNDD-UHFFFAOYSA-N
XLogP6.35
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.44
LogP ≤ 56.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2E)-2-(4,6-diphenylpyran-2-ylidene)-N-(4-methoxyphenyl)ethanimine
CID 6518633
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CID 3120316
6-(4-methoxyphenyl)-2,4-diphenyl-2H-pyran
CID 57376774
4-[(4E)-4-[(4-methoxyphenyl)methylidene]-5,5-diphenylfuran-2-yl]benzonitrile
CID 102082418
1-methoxy-4-phenylbenzene;methyloxidanium
CID 144616924
1-methoxy-4-(4-phenylbuta-1,3-dienyl)benzene
CID 4560156
3-(4-methoxyphenyl)-4-methyl-6-phenyl-2H-1,3-oxazin-3-ium
CID 21342454
1-methoxy-4-phenylbenzene cyanide
CID 159561637
1-[4-(4-methoxyphenyl)phenyl]-3,5-diphenylbenzene
CID 176774050
1-[4-(4-methoxyphenyl)phenyl]-2,4,6-triphenyl-3,5-bis(4-phenylphenyl)benzene
CID 138981847
(3Z)-3-[(2,4-dimethoxyphenyl)methylidene]-5-phenylfuran-2-one
CID 754604
3-[(4-methoxyphenyl)methylidene]-5-(4-propan-2-ylphenyl)furan-2-one
CID 809070

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran?
The IUPAC name of 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran (CID 5074511) is 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran.
What is the SMILES notation for 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran?
The canonical SMILES for 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran is COc1ccc(C=C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)cc1.
What is the InChIKey of 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran?
The InChIKey is WZBARJGXQUJNDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20O2/c1-27-24-16-14-20(15-17-24)12-13-21-18-25(22-8-4-2-5-9-22)28-26(19-21)23-10-6-3-7-11-23/h2-12,14-19H,1H3.
What are the key properties of 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran?
4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran has a molecular weight of 364.44 g/mol, XLogP of 6.35, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-methoxyphenyl)ethenylidene]-2,6-diphenylpyran is sourced from PubChem (CID 5074511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).