3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole

C9H5ClN4S — CID 102627264

IUPAC3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole
SMILESClc1nsnc1-c1cccc2nccn12
InChIInChI=1S/C9H5ClN4S/c10-9-8(12-15-13-9)6-2-1-3-7-11-4-5-14(6)7/h1-5H
InChIKeyMDILAOAQVZZWGW-UHFFFAOYSA-N
MW236.69 g/mol
LogP2.51
Rot. Bonds1

About 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole

3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole (PubChem CID 102627264) has the molecular formula C9H5ClN4S and a molecular weight of 236.69 g/mol. Its IUPAC name is 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole.

Molecular Properties

Compound Name3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole
PubChem CID102627264
Molecular FormulaC9H5ClN4S
Molecular Weight236.69 g/mol
Exact Mass235.99
IUPAC Name3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole
SMILESClc1nsnc1-c1cccc2nccn12
InChIInChI=1S/C9H5ClN4S/c10-9-8(12-15-13-9)6-2-1-3-7-11-4-5-14(6)7/h1-5H
InChIKeyMDILAOAQVZZWGW-UHFFFAOYSA-N
XLogP2.51
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.69
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole?
The IUPAC name of 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole (CID 102627264) is 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole.
What is the SMILES notation for 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole?
The canonical SMILES for 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole is Clc1nsnc1-c1cccc2nccn12.
What is the InChIKey of 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole?
The InChIKey is MDILAOAQVZZWGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5ClN4S/c10-9-8(12-15-13-9)6-2-1-3-7-11-4-5-14(6)7/h1-5H.
What are the key properties of 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole?
3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole has a molecular weight of 236.69 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole is sourced from PubChem (CID 102627264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).