4-(5-chlorothiophen-2-yl)thiadiazole

C6H3ClN2S2 — CID 587020

IUPAC4-(5-chlorothiophen-2-yl)thiadiazole
SMILESClc1ccc(-c2csnn2)s1
InChIInChI=1S/C6H3ClN2S2/c7-6-2-1-5(11-6)4-3-10-9-8-4/h1-3H
InChIKeyZVYCNKGXSWZBTQ-UHFFFAOYSA-N
MW202.69 g/mol
LogP2.92
Rot. Bonds1

About 4-(5-chlorothiophen-2-yl)thiadiazole

4-(5-chlorothiophen-2-yl)thiadiazole (PubChem CID 587020) has the molecular formula C6H3ClN2S2 and a molecular weight of 202.69 g/mol. Its IUPAC name is 4-(5-chlorothiophen-2-yl)thiadiazole.

Molecular Properties

Compound Name4-(5-chlorothiophen-2-yl)thiadiazole
PubChem CID587020
Molecular FormulaC6H3ClN2S2
Molecular Weight202.69 g/mol
Exact Mass201.94
IUPAC Name4-(5-chlorothiophen-2-yl)thiadiazole
SMILESClc1ccc(-c2csnn2)s1
InChIInChI=1S/C6H3ClN2S2/c7-6-2-1-5(11-6)4-3-10-9-8-4/h1-3H
InChIKeyZVYCNKGXSWZBTQ-UHFFFAOYSA-N
XLogP2.92
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.69
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(5-chlorothiophen-2-yl)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 4-(5-chlorothiophen-2-yl)thiadiazole?
The IUPAC name of 4-(5-chlorothiophen-2-yl)thiadiazole (CID 587020) is 4-(5-chlorothiophen-2-yl)thiadiazole.
What is the SMILES notation for 4-(5-chlorothiophen-2-yl)thiadiazole?
The canonical SMILES for 4-(5-chlorothiophen-2-yl)thiadiazole is Clc1ccc(-c2csnn2)s1.
What is the InChIKey of 4-(5-chlorothiophen-2-yl)thiadiazole?
The InChIKey is ZVYCNKGXSWZBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClN2S2/c7-6-2-1-5(11-6)4-3-10-9-8-4/h1-3H.
What are the key properties of 4-(5-chlorothiophen-2-yl)thiadiazole?
4-(5-chlorothiophen-2-yl)thiadiazole has a molecular weight of 202.69 g/mol, XLogP of 2.92, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-chlorothiophen-2-yl)thiadiazole is sourced from PubChem (CID 587020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).