2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene

C28H18S4 — CID 25194793

IUPAC2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene
SMILESc1csc(-c2cc(-c3cc(-c4cccs4)cc(-c4cccs4)c3)cc(-c3cccs3)c2)c1
InChIInChI=1S/C28H18S4/c1-5-25(29-9-1)21-13-19(14-22(17-21)26-6-2-10-30-26)20-15-23(27-7-3-11-31-27)18-24(16-20)28-8-4-12-32-28/h1-18H
InChIKeyJFSZQYWDGQIARV-UHFFFAOYSA-N
MW482.72 g/mol
LogP10.27
Rot. Bonds5

About 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene

2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene (PubChem CID 25194793) has the molecular formula C28H18S4 and a molecular weight of 482.72 g/mol. Its IUPAC name is 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene.

Molecular Properties

Compound Name2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene
PubChem CID25194793
Molecular FormulaC28H18S4
Molecular Weight482.72 g/mol
Exact Mass482.03
IUPAC Name2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene
SMILESc1csc(-c2cc(-c3cc(-c4cccs4)cc(-c4cccs4)c3)cc(-c3cccs3)c2)c1
InChIInChI=1S/C28H18S4/c1-5-25(29-9-1)21-13-19(14-22(17-21)26-6-2-10-30-26)20-15-23(27-7-3-11-31-27)18-24(16-20)28-8-4-12-32-28/h1-18H
InChIKeyJFSZQYWDGQIARV-UHFFFAOYSA-N
XLogP10.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.72
LogP ≤ 510.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,5-dibromophenyl)thiophene
CID 19006176
2-(7-thiophen-2-ylnaphthalen-2-yl)thiophene
CID 824515
6-phenylcyclopenta[b]thiopyran
CID 175596578
2-[3-[3-(3-phenyl-5-thiophen-2-ylphenyl)phenyl]phenyl]pyridine
CID 140587162
1-N,1-N,3-N,3-N-tetraphenyl-5-thiophen-2-ylbenzene-1,3-diamine
CID 23074711
2,6-bis(methylsulfanyl)-4-thiophen-2-ylpyridine
CID 14202028
2-(3-fluorophenyl)thiophene
CID 22486407
4-thiophen-2-ylthiophen-2-ol
CID 154302711
6-chloro-4-thiophen-2-ylpyridin-2-amine
CID 96614062
2,3-dimethyl-5-thiophen-2-ylphenol
CID 173292102
2-[3-(4-tert-butylphenyl)phenyl]thiophene
CID 174720161
ethane;2-(3-methylphenyl)thiophene
CID 143181554

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene?
The IUPAC name of 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene (CID 25194793) is 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene.
What is the SMILES notation for 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene?
The canonical SMILES for 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene is c1csc(-c2cc(-c3cc(-c4cccs4)cc(-c4cccs4)c3)cc(-c3cccs3)c2)c1.
What is the InChIKey of 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene?
The InChIKey is JFSZQYWDGQIARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H18S4/c1-5-25(29-9-1)21-13-19(14-22(17-21)26-6-2-10-30-26)20-15-23(27-7-3-11-31-27)18-24(16-20)28-8-4-12-32-28/h1-18H.
What are the key properties of 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene?
2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene has a molecular weight of 482.72 g/mol, XLogP of 10.27, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene is sourced from PubChem (CID 25194793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).