6-methylsulfanylimidazo[2,1-b][1,3]thiazole

C6H6N2S2 — CID 14422460

IUPAC6-methylsulfanylimidazo[2,1-b][1,3]thiazole
SMILESCSc1cn2ccsc2n1
InChIInChI=1S/C6H6N2S2/c1-9-5-4-8-2-3-10-6(8)7-5/h2-4H,1H3
InChIKeyJBULERCSMFLWNP-UHFFFAOYSA-N
MW170.26 g/mol
LogP2.12
Rot. Bonds1

About 6-methylsulfanylimidazo[2,1-b][1,3]thiazole

6-methylsulfanylimidazo[2,1-b][1,3]thiazole (PubChem CID 14422460) has the molecular formula C6H6N2S2 and a molecular weight of 170.26 g/mol. Its IUPAC name is 6-methylsulfanylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-methylsulfanylimidazo[2,1-b][1,3]thiazole
PubChem CID14422460
Molecular FormulaC6H6N2S2
Molecular Weight170.26 g/mol
Exact Mass170.00
IUPAC Name6-methylsulfanylimidazo[2,1-b][1,3]thiazole
SMILESCSc1cn2ccsc2n1
InChIInChI=1S/C6H6N2S2/c1-9-5-4-8-2-3-10-6(8)7-5/h2-4H,1H3
InChIKeyJBULERCSMFLWNP-UHFFFAOYSA-N
XLogP2.12
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-Chloroimidazo(2,1-b)thiazole
CID 721582
Imidazo(2,1-b)thiazole
CID 817024
(6-Chloroimidazo[2,1-b][1,3]thiazol-5-yl) thiocyanate
CID 2386913
6-Bromoimidazo[2,1-b][1,3]thiazole
CID 329949
5-Bromoimidazo(2,1-b)(1,3)thiazole
CID 76848570
6-Chloroimidazo(2,1-b)(1,3)thiazole-5-sulfonyl chloride
CID 2799717
7-Bromoimidazo[4,3-b][1,3]thiazole
CID 21262349
5,7-Dibromoimidazo[4,3-b][1,3]thiazole
CID 21262441
Imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 22641637
6-Bromoimidazo[2,1-b]thiazole-5-sulfonyl chloride
CID 25267672
2-Bromoimidazo[2,1-b][1,3]thiazole
CID 45158653
Imidazo[2,1-b][1,3]thiazole-2-sulfonamide;hydrobromide
CID 45264027

Frequently Asked Questions

What is the IUPAC name of 6-methylsulfanylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-methylsulfanylimidazo[2,1-b][1,3]thiazole (CID 14422460) is 6-methylsulfanylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-methylsulfanylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-methylsulfanylimidazo[2,1-b][1,3]thiazole is CSc1cn2ccsc2n1.
What is the InChIKey of 6-methylsulfanylimidazo[2,1-b][1,3]thiazole?
The InChIKey is JBULERCSMFLWNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2S2/c1-9-5-4-8-2-3-10-6(8)7-5/h2-4H,1H3.
What are the key properties of 6-methylsulfanylimidazo[2,1-b][1,3]thiazole?
6-methylsulfanylimidazo[2,1-b][1,3]thiazole has a molecular weight of 170.26 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylsulfanylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 14422460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).