1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene

C30H26O2 — CID 54482883

IUPAC1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
SMILESCOc1ccc(C=Cc2ccc(-c3ccc(C=Cc4ccc(OC)cc4)cc3)cc2)cc1
InChIInChI=1S/C30H26O2/c1-31-29-19-11-25(12-20-29)5-3-23-7-15-27(16-8-23)28-17-9-24(10-18-28)4-6-26-13-21-30(32-2)22-14-26/h3-22H,1-2H3
InChIKeyXQGLWLXRJJCZSL-UHFFFAOYSA-N
MW418.54 g/mol
LogP7.71
Rot. Bonds7

About 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene

1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene (PubChem CID 54482883) has the molecular formula C30H26O2 and a molecular weight of 418.54 g/mol. Its IUPAC name is 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
PubChem CID54482883
Molecular FormulaC30H26O2
Molecular Weight418.54 g/mol
Exact Mass418.19
IUPAC Name1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
SMILESCOc1ccc(C=Cc2ccc(-c3ccc(C=Cc4ccc(OC)cc4)cc3)cc2)cc1
InChIInChI=1S/C30H26O2/c1-31-29-19-11-25(12-20-29)5-3-23-7-15-27(16-8-23)28-17-9-24(10-18-28)4-6-26-13-21-30(32-2)22-14-26/h3-22H,1-2H3
InChIKeyXQGLWLXRJJCZSL-UHFFFAOYSA-N
XLogP7.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.54
LogP ≤ 57.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
CID 76573307
1,3-dimethoxy-5-[2-(4-methoxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)ethenyl]benzene
CID 57369399
1-methoxy-4-prop-1-enylbenzene
CID 67322568
4-[(E)-2-[4-(4-methoxyphenyl)phenyl]ethenyl]pyrimidine
CID 57409110
1-[(Z)-2-bromoethenyl]-4-methoxybenzene
CID 6166616
CID 135078844
CID 135078844
4-[2-[4-(4-methoxyphenyl)phenyl]ethenyl]-2H-triazole
CID 158018374
1-ethyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 21449166
2-[2-(4-methoxyphenyl)ethenyl]-1,3,5-trimethylbenzene
CID 69464209
4-[4-(4-methoxyphenyl)buta-1,3-dienyl]-N-[4-[4-(N-[4-[4-(4-methoxyphenyl)buta-1,3-dienyl]phenyl]anilino)phenyl]phenyl]-N-phenylaniline
CID 59103440
4-[(Z)-2-(4-methoxyphenyl)ethenyl]-1,2-dimethylbenzene
CID 10999067
4-[(E)-2-(4-methoxyphenyl)ethenyl]-2,6-dimethylpyridine
CID 102336030

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene?
The IUPAC name of 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene (CID 54482883) is 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene.
What is the SMILES notation for 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene?
The canonical SMILES for 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene is COc1ccc(C=Cc2ccc(-c3ccc(C=Cc4ccc(OC)cc4)cc3)cc2)cc1.
What is the InChIKey of 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene?
The InChIKey is XQGLWLXRJJCZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H26O2/c1-31-29-19-11-25(12-20-29)5-3-23-7-15-27(16-8-23)28-17-9-24(10-18-28)4-6-26-13-21-30(32-2)22-14-26/h3-22H,1-2H3.
What are the key properties of 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene?
1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene has a molecular weight of 418.54 g/mol, XLogP of 7.71, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene is sourced from PubChem (CID 54482883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).