2,8-dimethylimidazo[2,1-b][1,3]benzothiazole

C11H10N2S — CID 10845795

IUPAC2,8-dimethylimidazo[2,1-b][1,3]benzothiazole
SMILESCc1cn2c(n1)sc1cccc(C)c12
InChIInChI=1S/C11H10N2S/c1-7-4-3-5-9-10(7)13-6-8(2)12-11(13)14-9/h3-6H,1-2H3
InChIKeySWELCQLJVJMKPA-UHFFFAOYSA-N
MW202.28 g/mol
LogP3.17
Rot. Bonds

About 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole

2,8-dimethylimidazo[2,1-b][1,3]benzothiazole (PubChem CID 10845795) has the molecular formula C11H10N2S and a molecular weight of 202.28 g/mol. Its IUPAC name is 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole.

Molecular Properties

Compound Name2,8-dimethylimidazo[2,1-b][1,3]benzothiazole
PubChem CID10845795
Molecular FormulaC11H10N2S
Molecular Weight202.28 g/mol
Exact Mass202.06
IUPAC Name2,8-dimethylimidazo[2,1-b][1,3]benzothiazole
SMILESCc1cn2c(n1)sc1cccc(C)c12
InChIInChI=1S/C11H10N2S/c1-7-4-3-5-9-10(7)13-6-8(2)12-11(13)14-9/h3-6H,1-2H3
InChIKeySWELCQLJVJMKPA-UHFFFAOYSA-N
XLogP3.17
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole?
The IUPAC name of 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole (CID 10845795) is 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole.
What is the SMILES notation for 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole?
The canonical SMILES for 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole is Cc1cn2c(n1)sc1cccc(C)c12.
What is the InChIKey of 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole?
The InChIKey is SWELCQLJVJMKPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2S/c1-7-4-3-5-9-10(7)13-6-8(2)12-11(13)14-9/h3-6H,1-2H3.
What are the key properties of 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole?
2,8-dimethylimidazo[2,1-b][1,3]benzothiazole has a molecular weight of 202.28 g/mol, XLogP of 3.17, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethylimidazo[2,1-b][1,3]benzothiazole is sourced from PubChem (CID 10845795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).