5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole

C5H8N2S3 — CID 141307566

IUPAC5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole
SMILESCSCc1nnsc1SC
InChIInChI=1S/C5H8N2S3/c1-8-3-4-5(9-2)10-7-6-4/h3H2,1-2H3
InChIKeyMARNXZAJZHDCFT-UHFFFAOYSA-N
MW192.33 g/mol
LogP2.12
Rot. Bonds3

About 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole

5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole (PubChem CID 141307566) has the molecular formula C5H8N2S3 and a molecular weight of 192.33 g/mol. Its IUPAC name is 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole.

Molecular Properties

Compound Name5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole
PubChem CID141307566
Molecular FormulaC5H8N2S3
Molecular Weight192.33 g/mol
Exact Mass191.98
IUPAC Name5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole
SMILESCSCc1nnsc1SC
InChIInChI=1S/C5H8N2S3/c1-8-3-4-5(9-2)10-7-6-4/h3H2,1-2H3
InChIKeyMARNXZAJZHDCFT-UHFFFAOYSA-N
XLogP2.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.33
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole?
The IUPAC name of 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole (CID 141307566) is 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole.
What is the SMILES notation for 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole?
The canonical SMILES for 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole is CSCc1nnsc1SC.
What is the InChIKey of 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole?
The InChIKey is MARNXZAJZHDCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2S3/c1-8-3-4-5(9-2)10-7-6-4/h3H2,1-2H3.
What are the key properties of 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole?
5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole has a molecular weight of 192.33 g/mol, XLogP of 2.12, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylsulfanyl-4-(methylsulfanylmethyl)thiadiazole is sourced from PubChem (CID 141307566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).