5-bromo-6-methylimidazo[2,1-b][1,3]thiazole

C6H5BrN2S — CID 700760

IUPAC5-bromo-6-methylimidazo[2,1-b][1,3]thiazole
SMILESCc1nc2sccn2c1Br
InChIInChI=1S/C6H5BrN2S/c1-4-5(7)9-2-3-10-6(9)8-4/h2-3H,1H3
InChIKeyVFTRBNIGZDVDMT-UHFFFAOYSA-N
MW217.09 g/mol
LogP2.47
Rot. Bonds

About 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole

5-bromo-6-methylimidazo[2,1-b][1,3]thiazole (PubChem CID 700760) has the molecular formula C6H5BrN2S and a molecular weight of 217.09 g/mol. Its IUPAC name is 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name5-bromo-6-methylimidazo[2,1-b][1,3]thiazole
PubChem CID700760
Molecular FormulaC6H5BrN2S
Molecular Weight217.09 g/mol
Exact Mass215.94
IUPAC Name5-bromo-6-methylimidazo[2,1-b][1,3]thiazole
SMILESCc1nc2sccn2c1Br
InChIInChI=1S/C6H5BrN2S/c1-4-5(7)9-2-3-10-6(9)8-4/h2-3H,1H3
InChIKeyVFTRBNIGZDVDMT-UHFFFAOYSA-N
XLogP2.47
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.09
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-Bromoimidazo[2,1-b][1,3]thiazole
CID 329949
5-Bromoimidazo(2,1-b)(1,3)thiazole
CID 76848570
6-Methylimidazo[2,1-b][1,3]thiazole-5-carbonitrile
CID 333031
Imidazo(2,1-b)(1,3)thiazol-6-ylmethanamine
CID 4680249
6-(Cyclohexylsulfanylmethyl)imidazo[2,1-b][1,3]thiazole
CID 2998005
6-Methylimidazo[2,1-b][1,3]thiazole-5-carbothioamide
CID 16790119
2-Bromo-6-methylimidazo[2,1-b][1,3]thiazole
CID 118140654
6-Bromo-2-methylimidazo[2,1-b][1,3]thiazole
CID 154733368
3-[(5-Bromoimidazo[2,1-b][1,3]thiazol-6-yl)methylsulfanyl]thiolane 1,1-dioxide
CID 2999876
6-(Bromomethyl)-5-nitroimidazo[2,1-b][1,3]thiazole
CID 45113541
2-[(E)-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino]guanidine;hydrochloride
CID 45265236
3-Methyl-6-(trifluoromethyl)imidazo[2,1-b]thiazole
CID 72183228

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole (CID 700760) is 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole is Cc1nc2sccn2c1Br.
What is the InChIKey of 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole?
The InChIKey is VFTRBNIGZDVDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5BrN2S/c1-4-5(7)9-2-3-10-6(9)8-4/h2-3H,1H3.
What are the key properties of 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole?
5-bromo-6-methylimidazo[2,1-b][1,3]thiazole has a molecular weight of 217.09 g/mol, XLogP of 2.47, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-methylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 700760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).