2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene

C38H22S6 — CID 25214336

About 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene

2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene (PubChem CID 25214336) has the molecular formula C38H22S6 and a molecular weight of 671.00 g/mol. Its IUPAC name is 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene.

Molecular Properties

• Compound Name: 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene
• PubChem CID: 25214336
• Molecular Formula: C38H22S6
• Molecular Weight: 671.00 g/mol
• Exact Mass: 670.00
• IUPAC Name: 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene
• SMILES: c1ccc2c(c1)Cc1cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7cc8c(s7)-c7ccccc7C8)s6)s5)s4)s3)sc1-2
• InChI: InChI=1S/C38H22S6/c1-3-7-25-21(5-1)17-23-19-35(43-37(23)25)33-15-13-31(41-33)29-11-9-27(39-29)28-10-12-30(40-28)32-14-16-34(42-32)36-20-24-18-22-6-2-4-8-26(22)38(24)44-36/h1-16,19-20H,17-18H2
• InChIKey: ZGAZWVPKWQZVIR-UHFFFAOYSA-N
• XLogP: 13.53
• TPSA: 0.00 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	671.00
LogP ≤ 5	13.53
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene?

The IUPAC name of 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene (CID 25214336) is 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene.

What is the SMILES notation for 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene?

The canonical SMILES for 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene is c1ccc2c(c1)Cc1cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7cc8c(s7)-c7ccccc7C8)s6)s5)s4)s3)sc1-2.

What is the InChIKey of 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene?

The InChIKey is ZGAZWVPKWQZVIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H22S6/c1-3-7-25-21(5-1)17-23-19-35(43-37(23)25)33-15-13-31(41-33)29-11-9-27(39-29)28-10-12-30(40-28)32-14-16-34(42-32)36-20-24-18-22-6-2-4-8-26(22)38(24)44-36/h1-16,19-20H,17-18H2.

What are the key properties of 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene?

2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene has a molecular weight of 671.00 g/mol, XLogP of 13.53, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-[5-[5-[5-(4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-4H-indeno[1,2-b]thiophene is sourced from PubChem (CID 25214336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).