5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole

C6H10N2S3 — CID 141307555

IUPAC5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole
SMILESCSc1snnc1C(C)SC
InChIInChI=1S/C6H10N2S3/c1-4(9-2)5-6(10-3)11-8-7-5/h4H,1-3H3
InChIKeyPYBZEFCVRIBJKE-UHFFFAOYSA-N
MW206.36 g/mol
LogP2.68
Rot. Bonds3

About 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole

5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole (PubChem CID 141307555) has the molecular formula C6H10N2S3 and a molecular weight of 206.36 g/mol. Its IUPAC name is 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole.

Molecular Properties

Compound Name5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole
PubChem CID141307555
Molecular FormulaC6H10N2S3
Molecular Weight206.36 g/mol
Exact Mass206.00
IUPAC Name5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole
SMILESCSc1snnc1C(C)SC
InChIInChI=1S/C6H10N2S3/c1-4(9-2)5-6(10-3)11-8-7-5/h4H,1-3H3
InChIKeyPYBZEFCVRIBJKE-UHFFFAOYSA-N
XLogP2.68
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.36
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole?
The IUPAC name of 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole (CID 141307555) is 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole.
What is the SMILES notation for 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole?
The canonical SMILES for 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole is CSc1snnc1C(C)SC.
What is the InChIKey of 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole?
The InChIKey is PYBZEFCVRIBJKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S3/c1-4(9-2)5-6(10-3)11-8-7-5/h4H,1-3H3.
What are the key properties of 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole?
5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole has a molecular weight of 206.36 g/mol, XLogP of 2.68, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylsulfanyl-4-(1-methylsulfanylethyl)thiadiazole is sourced from PubChem (CID 141307555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).