2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene

C32H26S8 — CID 15252879

IUPAC2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene
SMILESCc1csc2c(C)c(-c3sc4c(C)c(-c5sc6c(C)c(-c7sc8c(C)csc8c7C)sc6c5C)sc4c3C)sc12
InChIInChI=1S/C32H26S8/c1-11-9-33-21-13(3)23(35-19(11)21)25-15(5)27-29(37-25)17(7)31(39-27)32-18(8)30-28(40-32)16(6)26(38-30)24-14(4)22-20(36-24)12(2)10-34-22/h9-10H,1-8H3
InChIKeyLQNYBVBUPDTBMQ-UHFFFAOYSA-N
MW667.10 g/mol
LogP14.26
Rot. Bonds3

About 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene

2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene (PubChem CID 15252879) has the molecular formula C32H26S8 and a molecular weight of 667.10 g/mol. Its IUPAC name is 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene.

Molecular Properties

Compound Name2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene
PubChem CID15252879
Molecular FormulaC32H26S8
Molecular Weight667.10 g/mol
Exact Mass665.98
IUPAC Name2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene
SMILESCc1csc2c(C)c(-c3sc4c(C)c(-c5sc6c(C)c(-c7sc8c(C)csc8c7C)sc6c5C)sc4c3C)sc12
InChIInChI=1S/C32H26S8/c1-11-9-33-21-13(3)23(35-19(11)21)25-15(5)27-29(37-25)17(7)31(39-27)32-18(8)30-28(40-32)16(6)26(38-30)24-14(4)22-20(36-24)12(2)10-34-22/h9-10H,1-8H3
InChIKeyLQNYBVBUPDTBMQ-UHFFFAOYSA-N
XLogP14.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500667.10
LogP ≤ 514.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene?
The IUPAC name of 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene (CID 15252879) is 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene.
What is the SMILES notation for 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene?
The canonical SMILES for 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene is Cc1csc2c(C)c(-c3sc4c(C)c(-c5sc6c(C)c(-c7sc8c(C)csc8c7C)sc6c5C)sc4c3C)sc12.
What is the InChIKey of 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene?
The InChIKey is LQNYBVBUPDTBMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26S8/c1-11-9-33-21-13(3)23(35-19(11)21)25-15(5)27-29(37-25)17(7)31(39-27)32-18(8)30-28(40-32)16(6)26(38-30)24-14(4)22-20(36-24)12(2)10-34-22/h9-10H,1-8H3.
What are the key properties of 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene?
2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene has a molecular weight of 667.10 g/mol, XLogP of 14.26, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-5-[2-(3,6-dimethylthieno[3,2-b]thiophen-5-yl)-3,6-dimethylthieno[3,2-b]thiophen-5-yl]-3,6-dimethylthieno[3,2-b]thiophene is sourced from PubChem (CID 15252879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).