3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole

C10H5ClN4S — CID 102944118

IUPAC3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole
SMILESClc1nsc(-c2cccc3nccnc23)n1
InChIInChI=1S/C10H5ClN4S/c11-10-14-9(16-15-10)6-2-1-3-7-8(6)13-5-4-12-7/h1-5H
InChIKeyJSXZKLCLGLDFKD-UHFFFAOYSA-N
MW248.70 g/mol
LogP2.80
Rot. Bonds1

About 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole

3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole (PubChem CID 102944118) has the molecular formula C10H5ClN4S and a molecular weight of 248.70 g/mol. Its IUPAC name is 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole.

Molecular Properties

Compound Name3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole
PubChem CID102944118
Molecular FormulaC10H5ClN4S
Molecular Weight248.70 g/mol
Exact Mass247.99
IUPAC Name3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole
SMILESClc1nsc(-c2cccc3nccnc23)n1
InChIInChI=1S/C10H5ClN4S/c11-10-14-9(16-15-10)6-2-1-3-7-8(6)13-5-4-12-7/h1-5H
InChIKeyJSXZKLCLGLDFKD-UHFFFAOYSA-N
XLogP2.80
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.70
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole with MolForge

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

Launch Full Analysis

Related Compounds

2-(2-chloroethyl)-5-quinoxalin-5-yl-1,3,4-thiadiazole
CID 113433279
3-chloro-5-(2-chlorofuran-3-yl)-1,2,4-thiadiazole
CID 106694860
2-quinoxalin-5-ylquinazoline
CID 91555305
N-[2-(5-quinoxalin-5-yl-1,3,4-thiadiazol-2-yl)ethyl]propan-2-amine
CID 104615846
3-chloro-5-(2,4-dimethylphenyl)-1,2,4-thiadiazole
CID 102944087
2-(5-quinoxalin-5-yl-1,2,4-oxadiazol-3-yl)ethanamine
CID 104615619
N-ethyl-1-(5-quinoxalin-5-yl-1,3,4-thiadiazol-2-yl)ethanamine
CID 104615841
5-benzo[a]anthracen-1-ylquinoxaline
CID 143739658
5-(4-fluoro-1H-benzimidazol-2-yl)quinoxaline
CID 104615382
5-(7-chloro-[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)quinoxaline
CID 104615353
5-(4-methyl-1H-benzimidazol-2-yl)quinoxaline
CID 104615378
5-quinoxalin-5-yl-3-(thiophen-3-ylmethyl)-1,2,4-oxadiazole
CID 28736924

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole?
The IUPAC name of 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole (CID 102944118) is 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole.
What is the SMILES notation for 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole?
The canonical SMILES for 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole is Clc1nsc(-c2cccc3nccnc23)n1.
What is the InChIKey of 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole?
The InChIKey is JSXZKLCLGLDFKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5ClN4S/c11-10-14-9(16-15-10)6-2-1-3-7-8(6)13-5-4-12-7/h1-5H.
What are the key properties of 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole?
3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole has a molecular weight of 248.70 g/mol, XLogP of 2.80, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-quinoxalin-5-yl-1,2,4-thiadiazole is sourced from PubChem (CID 102944118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).