2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene

C18H12S4 — CID 11810434

IUPAC2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene
SMILESC(=C/c1ccc(-c2cccs2)s1)\c1ccc(-c2cccs2)s1
InChIInChI=1S/C18H12S4/c1-3-15(19-11-1)17-9-7-13(21-17)5-6-14-8-10-18(22-14)16-4-2-12-20-16/h1-12H/b6-5+
InChIKeyWHIPBZVMUZAWFT-AATRIKPKSA-N
MW356.56 g/mol
LogP7.44
Rot. Bonds4

About 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene

2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene (PubChem CID 11810434) has the molecular formula C18H12S4 and a molecular weight of 356.56 g/mol. Its IUPAC name is 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene.

Molecular Properties

Compound Name2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene
PubChem CID11810434
Molecular FormulaC18H12S4
Molecular Weight356.56 g/mol
Exact Mass355.98
IUPAC Name2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene
SMILESC(=C/c1ccc(-c2cccs2)s1)\c1ccc(-c2cccs2)s1
InChIInChI=1S/C18H12S4/c1-3-15(19-11-1)17-9-7-13(21-17)5-6-14-8-10-18(22-14)16-4-2-12-20-16/h1-12H/b6-5+
InChIKeyWHIPBZVMUZAWFT-AATRIKPKSA-N
XLogP7.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.56
LogP ≤ 57.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene?
The IUPAC name of 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene (CID 11810434) is 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene.
What is the SMILES notation for 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene?
The canonical SMILES for 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene is C(=C/c1ccc(-c2cccs2)s1)\c1ccc(-c2cccs2)s1.
What is the InChIKey of 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene?
The InChIKey is WHIPBZVMUZAWFT-AATRIKPKSA-N. The full InChI is InChI=1S/C18H12S4/c1-3-15(19-11-1)17-9-7-13(21-17)5-6-14-8-10-18(22-14)16-4-2-12-20-16/h1-12H/b6-5+.
What are the key properties of 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene?
2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene has a molecular weight of 356.56 g/mol, XLogP of 7.44, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-yl-5-[(E)-2-(5-thiophen-2-ylthiophen-2-yl)ethenyl]thiophene is sourced from PubChem (CID 11810434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).