2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene

C32H22S2 — CID 10648060

IUPAC2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene
SMILESc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccccc6)cc5)s4)s3)cc2)cc1
InChIInChI=1S/C32H22S2/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-31(33-29)32-22-20-30(34-32)28-17-13-26(14-18-28)24-9-5-2-6-10-24/h1-22H
InChIKeySJNXLFCTPWBYSE-UHFFFAOYSA-N
MW470.66 g/mol
LogP10.14
Rot. Bonds5

About 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene

2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene (PubChem CID 10648060) has the molecular formula C32H22S2 and a molecular weight of 470.66 g/mol. Its IUPAC name is 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene.

Molecular Properties

Compound Name2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene
PubChem CID10648060
Molecular FormulaC32H22S2
Molecular Weight470.66 g/mol
Exact Mass470.12
IUPAC Name2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene
SMILESc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccccc6)cc5)s4)s3)cc2)cc1
InChIInChI=1S/C32H22S2/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-31(33-29)32-22-20-30(34-32)28-17-13-26(14-18-28)24-9-5-2-6-10-24/h1-22H
InChIKeySJNXLFCTPWBYSE-UHFFFAOYSA-N
XLogP10.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.66
LogP ≤ 510.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene?
The IUPAC name of 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene (CID 10648060) is 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene.
What is the SMILES notation for 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene?
The canonical SMILES for 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene is c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccccc6)cc5)s4)s3)cc2)cc1.
What is the InChIKey of 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene?
The InChIKey is SJNXLFCTPWBYSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H22S2/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-31(33-29)32-22-20-30(34-32)28-17-13-26(14-18-28)24-9-5-2-6-10-24/h1-22H.
What are the key properties of 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene?
2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene has a molecular weight of 470.66 g/mol, XLogP of 10.14, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)-5-[5-(4-phenylphenyl)thiophen-2-yl]thiophene is sourced from PubChem (CID 10648060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).