4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine

C26H16N2S4 — CID 15302129

IUPAC4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine
SMILESc1cc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccncc6)s5)s4)s3)s2)ccn1
InChIInChI=1S/C26H16N2S4/c1-3-21(29-19(1)17-9-13-27-14-10-17)23-5-7-25(31-23)26-8-6-24(32-26)22-4-2-20(30-22)18-11-15-28-16-12-18/h1-16H
InChIKeySUNYMPBXPFAKKX-UHFFFAOYSA-N
MW484.70 g/mol
LogP9.06
Rot. Bonds5

About 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine

4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine (PubChem CID 15302129) has the molecular formula C26H16N2S4 and a molecular weight of 484.70 g/mol. Its IUPAC name is 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine.

Molecular Properties

Compound Name4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine
PubChem CID15302129
Molecular FormulaC26H16N2S4
Molecular Weight484.70 g/mol
Exact Mass484.02
IUPAC Name4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine
SMILESc1cc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccncc6)s5)s4)s3)s2)ccn1
InChIInChI=1S/C26H16N2S4/c1-3-21(29-19(1)17-9-13-27-14-10-17)23-5-7-25(31-23)26-8-6-24(32-26)22-4-2-20(30-22)18-11-15-28-16-12-18/h1-16H
InChIKeySUNYMPBXPFAKKX-UHFFFAOYSA-N
XLogP9.06
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.70
LogP ≤ 59.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine?
The IUPAC name of 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine (CID 15302129) is 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine.
What is the SMILES notation for 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine?
The canonical SMILES for 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine is c1cc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccncc6)s5)s4)s3)s2)ccn1.
What is the InChIKey of 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine?
The InChIKey is SUNYMPBXPFAKKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16N2S4/c1-3-21(29-19(1)17-9-13-27-14-10-17)23-5-7-25(31-23)26-8-6-24(32-26)22-4-2-20(30-22)18-11-15-28-16-12-18/h1-16H.
What are the key properties of 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine?
4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine has a molecular weight of 484.70 g/mol, XLogP of 9.06, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[5-[5-(5-pyridin-4-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine is sourced from PubChem (CID 15302129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).