3,4-diphenyl-2-thiophen-2-ylthiophene

C20H14S2 — CID 90930484

IUPAC3,4-diphenyl-2-thiophen-2-ylthiophene
SMILESc1ccc(-c2csc(-c3cccs3)c2-c2ccccc2)cc1
InChIInChI=1S/C20H14S2/c1-3-8-15(9-4-1)17-14-22-20(18-12-7-13-21-18)19(17)16-10-5-2-6-11-16/h1-14H
InChIKeyXDASUTQDWUULOY-UHFFFAOYSA-N
MW318.47 g/mol
LogP6.81
Rot. Bonds3

About 3,4-diphenyl-2-thiophen-2-ylthiophene

3,4-diphenyl-2-thiophen-2-ylthiophene (PubChem CID 90930484) has the molecular formula C20H14S2 and a molecular weight of 318.47 g/mol. Its IUPAC name is 3,4-diphenyl-2-thiophen-2-ylthiophene.

Molecular Properties

Compound Name3,4-diphenyl-2-thiophen-2-ylthiophene
PubChem CID90930484
Molecular FormulaC20H14S2
Molecular Weight318.47 g/mol
Exact Mass318.05
IUPAC Name3,4-diphenyl-2-thiophen-2-ylthiophene
SMILESc1ccc(-c2csc(-c3cccs3)c2-c2ccccc2)cc1
InChIInChI=1S/C20H14S2/c1-3-8-15(9-4-1)17-14-22-20(18-12-7-13-21-18)19(17)16-10-5-2-6-11-16/h1-14H
InChIKeyXDASUTQDWUULOY-UHFFFAOYSA-N
XLogP6.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.47
LogP ≤ 56.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene
CID 175170754
2,3-diphenyl-4,5-dithiophen-2-ylthiophene
CID 67533683
2-methylsulfanyl-3,4-diphenylthiophene
CID 23254570
3-(4-fluorophenyl)-4-methyl-2-thiophen-2-ylthiophene
CID 70009017
2-(3,4-diphenylphenyl)thiophene
CID 150825396
3-phenyl-4-thiophen-2-yl-1,2-thiazole
CID 141162564
1-(2,4-diphenylthiophen-3-yl)-3-phenyl-2-benzothiophene
CID 156552741
2-thiophen-2-ylcyclohepta-2,4,6-trien-1-one
CID 142643105
3,4-bis(7-hexyl-9H-fluoren-2-yl)-2-thiophen-2-ylthiophene
CID 175734952
2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene
CID 173096883
3,4,5-tris(2-phenylphenyl)-6-(3-phenyl-2-thiophen-2-ylphenyl)benzene-1,2-diamine
CID 166134005
3-phenyl-2-[4-(3-phenylthiophen-2-yl)phenyl]thiophene
CID 67533042

Frequently Asked Questions

What is the IUPAC name of 3,4-diphenyl-2-thiophen-2-ylthiophene?
The IUPAC name of 3,4-diphenyl-2-thiophen-2-ylthiophene (CID 90930484) is 3,4-diphenyl-2-thiophen-2-ylthiophene.
What is the SMILES notation for 3,4-diphenyl-2-thiophen-2-ylthiophene?
The canonical SMILES for 3,4-diphenyl-2-thiophen-2-ylthiophene is c1ccc(-c2csc(-c3cccs3)c2-c2ccccc2)cc1.
What is the InChIKey of 3,4-diphenyl-2-thiophen-2-ylthiophene?
The InChIKey is XDASUTQDWUULOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14S2/c1-3-8-15(9-4-1)17-14-22-20(18-12-7-13-21-18)19(17)16-10-5-2-6-11-16/h1-14H.
What are the key properties of 3,4-diphenyl-2-thiophen-2-ylthiophene?
3,4-diphenyl-2-thiophen-2-ylthiophene has a molecular weight of 318.47 g/mol, XLogP of 6.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diphenyl-2-thiophen-2-ylthiophene is sourced from PubChem (CID 90930484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).