4-methyl-5-methylsulfanylthiadiazole

C4H6N2S2 — CID 54281098

IUPAC4-methyl-5-methylsulfanylthiadiazole
SMILESCSc1snnc1C
InChIInChI=1S/C4H6N2S2/c1-3-4(7-2)8-6-5-3/h1-2H3
InChIKeyDFCJJCBWKGTONZ-UHFFFAOYSA-N
MW146.24 g/mol
LogP1.57
Rot. Bonds1

About 4-methyl-5-methylsulfanylthiadiazole

4-methyl-5-methylsulfanylthiadiazole (PubChem CID 54281098) has the molecular formula C4H6N2S2 and a molecular weight of 146.24 g/mol. Its IUPAC name is 4-methyl-5-methylsulfanylthiadiazole.

Molecular Properties

Compound Name4-methyl-5-methylsulfanylthiadiazole
PubChem CID54281098
Molecular FormulaC4H6N2S2
Molecular Weight146.24 g/mol
Exact Mass146.00
IUPAC Name4-methyl-5-methylsulfanylthiadiazole
SMILESCSc1snnc1C
InChIInChI=1S/C4H6N2S2/c1-3-4(7-2)8-6-5-3/h1-2H3
InChIKeyDFCJJCBWKGTONZ-UHFFFAOYSA-N
XLogP1.57
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.24
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-methylsulfanylthiadiazole?
The IUPAC name of 4-methyl-5-methylsulfanylthiadiazole (CID 54281098) is 4-methyl-5-methylsulfanylthiadiazole.
What is the SMILES notation for 4-methyl-5-methylsulfanylthiadiazole?
The canonical SMILES for 4-methyl-5-methylsulfanylthiadiazole is CSc1snnc1C.
What is the InChIKey of 4-methyl-5-methylsulfanylthiadiazole?
The InChIKey is DFCJJCBWKGTONZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2S2/c1-3-4(7-2)8-6-5-3/h1-2H3.
What are the key properties of 4-methyl-5-methylsulfanylthiadiazole?
4-methyl-5-methylsulfanylthiadiazole has a molecular weight of 146.24 g/mol, XLogP of 1.57, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-methylsulfanylthiadiazole is sourced from PubChem (CID 54281098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).