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

C5H7ClN2S2 — CID 141307570

IUPAC5-chloro-4-(1-methylsulfanylethyl)thiadiazole
SMILESCSC(C)c1nnsc1Cl
InChIInChI=1S/C5H7ClN2S2/c1-3(9-2)4-5(6)10-8-7-4/h3H,1-2H3
InChIKeyOLUUDCRXPJJIMH-UHFFFAOYSA-N
MW194.71 g/mol
LogP2.62
Rot. Bonds2

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

5-chloro-4-(1-methylsulfanylethyl)thiadiazole (PubChem CID 141307570) has the molecular formula C5H7ClN2S2 and a molecular weight of 194.71 g/mol. Its IUPAC name is 5-chloro-4-(1-methylsulfanylethyl)thiadiazole.

Molecular Properties

Compound Name5-chloro-4-(1-methylsulfanylethyl)thiadiazole
PubChem CID141307570
Molecular FormulaC5H7ClN2S2
Molecular Weight194.71 g/mol
Exact Mass193.97
IUPAC Name5-chloro-4-(1-methylsulfanylethyl)thiadiazole
SMILESCSC(C)c1nnsc1Cl
InChIInChI=1S/C5H7ClN2S2/c1-3(9-2)4-5(6)10-8-7-4/h3H,1-2H3
InChIKeyOLUUDCRXPJJIMH-UHFFFAOYSA-N
XLogP2.62
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.71
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-chloro-4-(1-methylsulfanylethyl)thiadiazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(1-methylsulfanylethyl)thiadiazole?
The IUPAC name of 5-chloro-4-(1-methylsulfanylethyl)thiadiazole (CID 141307570) is 5-chloro-4-(1-methylsulfanylethyl)thiadiazole.
What is the SMILES notation for 5-chloro-4-(1-methylsulfanylethyl)thiadiazole?
The canonical SMILES for 5-chloro-4-(1-methylsulfanylethyl)thiadiazole is CSC(C)c1nnsc1Cl.
What is the InChIKey of 5-chloro-4-(1-methylsulfanylethyl)thiadiazole?
The InChIKey is OLUUDCRXPJJIMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7ClN2S2/c1-3(9-2)4-5(6)10-8-7-4/h3H,1-2H3.
What are the key properties of 5-chloro-4-(1-methylsulfanylethyl)thiadiazole?
5-chloro-4-(1-methylsulfanylethyl)thiadiazole has a molecular weight of 194.71 g/mol, XLogP of 2.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(1-methylsulfanylethyl)thiadiazole is sourced from PubChem (CID 141307570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).