5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole

C11H7N3S3 — CID 2746630

IUPAC5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole
SMILESc1ccc(Sc2nc(-c3cccs3)ns2)nc1
InChIInChI=1S/C11H7N3S3/c1-2-6-12-9(5-1)16-11-13-10(14-17-11)8-4-3-7-15-8/h1-7H
InChIKeyNPIGBKXAUUAPSV-UHFFFAOYSA-N
MW277.40 g/mol
LogP3.81
Rot. Bonds3

About 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole

5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole (PubChem CID 2746630) has the molecular formula C11H7N3S3 and a molecular weight of 277.40 g/mol. Its IUPAC name is 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole.

Molecular Properties

Compound Name5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole
PubChem CID2746630
Molecular FormulaC11H7N3S3
Molecular Weight277.40 g/mol
Exact Mass276.98
IUPAC Name5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole
SMILESc1ccc(Sc2nc(-c3cccs3)ns2)nc1
InChIInChI=1S/C11H7N3S3/c1-2-6-12-9(5-1)16-11-13-10(14-17-11)8-4-3-7-15-8/h1-7H
InChIKeyNPIGBKXAUUAPSV-UHFFFAOYSA-N
XLogP3.81
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.40
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-pyridin-2-ylsulfanyl-1,3-thiazole
CID 15637338
5-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-thiophen-2-yl-1,2,4-thiadiazole
CID 2746675
3-[(3-phenyl-1,2,4-thiadiazol-5-yl)sulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine
CID 133492805
platinum;bis(2-thiophen-2-ylpyridine)
CID 87764255
4-methyl-2-thiophen-2-ylpyrimidine
CID 21025894
2-[2-(5-bromothiophen-2-yl)thiophen-3-yl]sulfanylpyridine
CID 90108006
2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine
CID 10734487
4,6-dichloro-2-pyrimidin-2-yl-5-thiophen-2-ylpyrimidine
CID 18931105
2-pyridin-2-ylsulfanyl-1-thiophen-2-ylethanone
CID 3876278
N-propyl-3-thiophen-2-yl-1,2,4-thiadiazol-5-amine
CID 65268420
3-thiophen-2-yl-1,2,4-benzotriazine
CID 135025345
4-methyl-2-pyridin-2-ylsulfanylpyridine
CID 91863117

Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole?
The IUPAC name of 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole (CID 2746630) is 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole.
What is the SMILES notation for 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole?
The canonical SMILES for 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole is c1ccc(Sc2nc(-c3cccs3)ns2)nc1.
What is the InChIKey of 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole?
The InChIKey is NPIGBKXAUUAPSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3S3/c1-2-6-12-9(5-1)16-11-13-10(14-17-11)8-4-3-7-15-8/h1-7H.
What are the key properties of 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole?
5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole has a molecular weight of 277.40 g/mol, XLogP of 3.81, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-ylsulfanyl-3-thiophen-2-yl-1,2,4-thiadiazole is sourced from PubChem (CID 2746630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).