3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole

C8H5FN2S2 — CID 154448516

IUPAC3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole
SMILESFc1ccc(Sc2cnsn2)cc1
InChIInChI=1S/C8H5FN2S2/c9-6-1-3-7(4-2-6)12-8-5-10-13-11-8/h1-5H
InChIKeyQZAKFHCCLXQZQI-UHFFFAOYSA-N
MW212.27 g/mol
LogP2.83
Rot. Bonds2

About 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole

3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole (PubChem CID 154448516) has the molecular formula C8H5FN2S2 and a molecular weight of 212.27 g/mol. Its IUPAC name is 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole.

Molecular Properties

Compound Name3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole
PubChem CID154448516
Molecular FormulaC8H5FN2S2
Molecular Weight212.27 g/mol
Exact Mass211.99
IUPAC Name3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole
SMILESFc1ccc(Sc2cnsn2)cc1
InChIInChI=1S/C8H5FN2S2/c9-6-1-3-7(4-2-6)12-8-5-10-13-11-8/h1-5H
InChIKeyQZAKFHCCLXQZQI-UHFFFAOYSA-N
XLogP2.83
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(4-fluorophenyl)sulfanyl-1,2,5-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

5-((2-fluorophenyl)thio)-1H-1,2,3-triazole-4-carboxylic acid
CID 155653402
5-((3-fluorophenyl)thio)-1H-1,2,3-triazole-4-carboxylic acid
CID 155653403
1-H-5-Thiobenzyl-1,2,3-triazole
CID 10012465
4-[4-(trifluoromethylsulfanyl)phenyl]sulfanyl-2H-triazole
CID 155653607
4-(3,4-difluorophenyl)sulfanyl-2H-triazole
CID 175748233
3-Chloro-4-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole
CID 43427025
3-Chloro-4-(2-fluorophenyl)sulfanyl-1,2,5-thiadiazole
CID 43808351
3-Chloro-4-(3-fluorophenyl)sulfanyl-1,2,5-thiadiazole
CID 80065143
3-[(3-Fluorophenyl)sulfinylmethyl]-1,2,5-thiadiazole
CID 130927637
4-phenylsulfanyl-2H-triazole;silver
CID 87874372
4-(2-phenylsulfanylethylsulfanyl)-2H-triazole
CID 84596368

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole?
The IUPAC name of 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole (CID 154448516) is 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole.
What is the SMILES notation for 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole?
The canonical SMILES for 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole is Fc1ccc(Sc2cnsn2)cc1.
What is the InChIKey of 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole?
The InChIKey is QZAKFHCCLXQZQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2S2/c9-6-1-3-7(4-2-6)12-8-5-10-13-11-8/h1-5H.
What are the key properties of 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole?
3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole has a molecular weight of 212.27 g/mol, XLogP of 2.83, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)sulfanyl-1,2,5-thiadiazole is sourced from PubChem (CID 154448516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).