2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan

C16H10O2S2 — CID 102347671

IUPAC2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan
SMILESc1csc(-c2ccc(-c3ccc(-c4cccs4)o3)o2)c1
InChIInChI=1S/C16H10O2S2/c1-3-15(19-9-1)13-7-5-11(17-13)12-6-8-14(18-12)16-4-2-10-20-16/h1-10H
InChIKeyKRHZXEKYYLDCBI-UHFFFAOYSA-N
MW298.39 g/mol
LogP6.00
Rot. Bonds3

About 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan

2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan (PubChem CID 102347671) has the molecular formula C16H10O2S2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan.

Molecular Properties

Compound Name2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan
PubChem CID102347671
Molecular FormulaC16H10O2S2
Molecular Weight298.39 g/mol
Exact Mass298.01
IUPAC Name2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan
SMILESc1csc(-c2ccc(-c3ccc(-c4cccs4)o3)o2)c1
InChIInChI=1S/C16H10O2S2/c1-3-15(19-9-1)13-7-5-11(17-13)12-6-8-14(18-12)16-4-2-10-20-16/h1-10H
InChIKeyKRHZXEKYYLDCBI-UHFFFAOYSA-N
XLogP6.00
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.39
LogP ≤ 56.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan?
The IUPAC name of 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan (CID 102347671) is 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan.
What is the SMILES notation for 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan?
The canonical SMILES for 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan is c1csc(-c2ccc(-c3ccc(-c4cccs4)o3)o2)c1.
What is the InChIKey of 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan?
The InChIKey is KRHZXEKYYLDCBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10O2S2/c1-3-15(19-9-1)13-7-5-11(17-13)12-6-8-14(18-12)16-4-2-10-20-16/h1-10H.
What are the key properties of 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan?
2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan has a molecular weight of 298.39 g/mol, XLogP of 6.00, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan is sourced from PubChem (CID 102347671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).