2,5-bis(furan-2-yl)-1,3,4-thiadiazole

C10H6N2O2S — CID 2753180

IUPAC2,5-bis(furan-2-yl)-1,3,4-thiadiazole
SMILESc1coc(-c2nnc(-c3ccco3)s2)c1
InChIInChI=1S/C10H6N2O2S/c1-3-7(13-5-1)9-11-12-10(15-9)8-4-2-6-14-8/h1-6H
InChIKeyQVBIAVOTUXMHMN-UHFFFAOYSA-N
MW218.24 g/mol
LogP3.06
Rot. Bonds2

About 2,5-bis(furan-2-yl)-1,3,4-thiadiazole

2,5-bis(furan-2-yl)-1,3,4-thiadiazole (PubChem CID 2753180) has the molecular formula C10H6N2O2S and a molecular weight of 218.24 g/mol. Its IUPAC name is 2,5-bis(furan-2-yl)-1,3,4-thiadiazole.

Molecular Properties

Compound Name2,5-bis(furan-2-yl)-1,3,4-thiadiazole
PubChem CID2753180
Molecular FormulaC10H6N2O2S
Molecular Weight218.24 g/mol
Exact Mass218.01
IUPAC Name2,5-bis(furan-2-yl)-1,3,4-thiadiazole
SMILESc1coc(-c2nnc(-c3ccco3)s2)c1
InChIInChI=1S/C10H6N2O2S/c1-3-7(13-5-1)9-11-12-10(15-9)8-4-2-6-14-8/h1-6H
InChIKeyQVBIAVOTUXMHMN-UHFFFAOYSA-N
XLogP3.06
TPSA52.06 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.24
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(furan-2-yl)-1,3,4-thiadiazole?
The IUPAC name of 2,5-bis(furan-2-yl)-1,3,4-thiadiazole (CID 2753180) is 2,5-bis(furan-2-yl)-1,3,4-thiadiazole.
What is the SMILES notation for 2,5-bis(furan-2-yl)-1,3,4-thiadiazole?
The canonical SMILES for 2,5-bis(furan-2-yl)-1,3,4-thiadiazole is c1coc(-c2nnc(-c3ccco3)s2)c1.
What is the InChIKey of 2,5-bis(furan-2-yl)-1,3,4-thiadiazole?
The InChIKey is QVBIAVOTUXMHMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6N2O2S/c1-3-7(13-5-1)9-11-12-10(15-9)8-4-2-6-14-8/h1-6H.
What are the key properties of 2,5-bis(furan-2-yl)-1,3,4-thiadiazole?
2,5-bis(furan-2-yl)-1,3,4-thiadiazole has a molecular weight of 218.24 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(furan-2-yl)-1,3,4-thiadiazole is sourced from PubChem (CID 2753180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).