(5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one

C13H8O2S2 — CID 24825845

IUPAC(5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one
SMILESO=C1C=C(c2ccsc2)/C(=C/c2ccsc2)O1
InChIInChI=1S/C13H8O2S2/c14-13-6-11(10-2-4-17-8-10)12(15-13)5-9-1-3-16-7-9/h1-8H/b12-5-
InChIKeyAZYLIGGEKWWIFG-XGICHPGQSA-N
MW260.34 g/mol
LogP3.79
Rot. Bonds2

About (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one

(5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one (PubChem CID 24825845) has the molecular formula C13H8O2S2 and a molecular weight of 260.34 g/mol. Its IUPAC name is (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one.

Molecular Properties

Compound Name(5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one
PubChem CID24825845
Molecular FormulaC13H8O2S2
Molecular Weight260.34 g/mol
Exact Mass260.00
IUPAC Name(5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one
SMILESO=C1C=C(c2ccsc2)/C(=C/c2ccsc2)O1
InChIInChI=1S/C13H8O2S2/c14-13-6-11(10-2-4-17-8-10)12(15-13)5-9-1-3-16-7-9/h1-8H/b12-5-
InChIKeyAZYLIGGEKWWIFG-XGICHPGQSA-N
XLogP3.79
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one?
The IUPAC name of (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one (CID 24825845) is (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one.
What is the SMILES notation for (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one?
The canonical SMILES for (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one is O=C1C=C(c2ccsc2)/C(=C/c2ccsc2)O1.
What is the InChIKey of (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one?
The InChIKey is AZYLIGGEKWWIFG-XGICHPGQSA-N. The full InChI is InChI=1S/C13H8O2S2/c14-13-6-11(10-2-4-17-8-10)12(15-13)5-9-1-3-16-7-9/h1-8H/b12-5-.
What are the key properties of (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one?
(5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one has a molecular weight of 260.34 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-4-thiophen-3-yl-5-(thiophen-3-ylmethylidene)furan-2-one is sourced from PubChem (CID 24825845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).