2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene

C54H34S6 — CID 139982021

IUPAC2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene
SMILESc1csc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7ccc(-c8ccc(-c9ccc(-c%10ccc(-c%11cccs%11)cc%10)s9)cc8)s7)cc6)s5)cc4)s3)cc2)c1
InChIInChI=1S/C54H34S6/c1-3-45(55-33-1)35-5-9-37(10-6-35)47-25-27-49(57-47)39-13-17-41(18-14-39)51-29-31-53(59-51)43-21-23-44(24-22-43)54-32-30-52(60-54)42-19-15-40(16-20-42)50-28-26-48(58-50)38-11-7-36(8-12-38)46-4-2-34-56-46/h1-34H
InChIKeyHVCZBRIMKGXSJC-UHFFFAOYSA-N
MW875.27 g/mol
LogP18.73
Rot. Bonds10

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

2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene (PubChem CID 139982021) has the molecular formula C54H34S6 and a molecular weight of 875.27 g/mol. Its IUPAC name is 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene.

Molecular Properties

Compound Name2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene
PubChem CID139982021
Molecular FormulaC54H34S6
Molecular Weight875.27 g/mol
Exact Mass874.10
IUPAC Name2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene
SMILESc1csc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7ccc(-c8ccc(-c9ccc(-c%10ccc(-c%11cccs%11)cc%10)s9)cc8)s7)cc6)s5)cc4)s3)cc2)c1
InChIInChI=1S/C54H34S6/c1-3-45(55-33-1)35-5-9-37(10-6-35)47-25-27-49(57-47)39-13-17-41(18-14-39)51-29-31-53(59-51)43-21-23-44(24-22-43)54-32-30-52(60-54)42-19-15-40(16-20-42)50-28-26-48(58-50)38-11-7-36(8-12-38)46-4-2-34-56-46/h1-34H
InChIKeyHVCZBRIMKGXSJC-UHFFFAOYSA-N
XLogP18.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500875.27
LogP ≤ 518.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene?
The IUPAC name of 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene (CID 139982021) is 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene.
What is the SMILES notation for 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene?
The canonical SMILES for 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene is c1csc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7ccc(-c8ccc(-c9ccc(-c%10ccc(-c%11cccs%11)cc%10)s9)cc8)s7)cc6)s5)cc4)s3)cc2)c1.
What is the InChIKey of 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene?
The InChIKey is HVCZBRIMKGXSJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34S6/c1-3-45(55-33-1)35-5-9-37(10-6-35)47-25-27-49(57-47)39-13-17-41(18-14-39)51-29-31-53(59-51)43-21-23-44(24-22-43)54-32-30-52(60-54)42-19-15-40(16-20-42)50-28-26-48(58-50)38-11-7-36(8-12-38)46-4-2-34-56-46/h1-34H.
What are the key properties of 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene?
2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene has a molecular weight of 875.27 g/mol, XLogP of 18.73, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-thiophen-2-ylphenyl)-5-[4-[5-[4-[5-[4-[5-(4-thiophen-2-ylphenyl)thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophen-2-yl]phenyl]thiophene is sourced from PubChem (CID 139982021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).