3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide

C12H12BrClN2S — CID 23723163

IUPAC3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide
SMILESBr.CC1CN2C(c3ccc(Cl)cc3)=CSC2=N1
InChIInChI=1S/C12H11ClN2S.BrH/c1-8-6-15-11(7-16-12(15)14-8)9-2-4-10(13)5-3-9;/h2-5,7-8H,6H2,1H3;1H
InChIKeyKZFXKAINCCNILB-UHFFFAOYSA-N
MW331.67 g/mol
LogP4.02
Rot. Bonds1

About 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide

3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide (PubChem CID 23723163) has the molecular formula C12H12BrClN2S and a molecular weight of 331.67 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide
PubChem CID23723163
Molecular FormulaC12H12BrClN2S
Molecular Weight331.67 g/mol
Exact Mass329.96
IUPAC Name3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide
SMILESBr.CC1CN2C(c3ccc(Cl)cc3)=CSC2=N1
InChIInChI=1S/C12H11ClN2S.BrH/c1-8-6-15-11(7-16-12(15)14-8)9-2-4-10(13)5-3-9;/h2-5,7-8H,6H2,1H3;1H
InChIKeyKZFXKAINCCNILB-UHFFFAOYSA-N
XLogP4.02
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.67
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide?
The IUPAC name of 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide (CID 23723163) is 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide.
What is the SMILES notation for 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide?
The canonical SMILES for 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide is Br.CC1CN2C(c3ccc(Cl)cc3)=CSC2=N1.
What is the InChIKey of 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide?
The InChIKey is KZFXKAINCCNILB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2S.BrH/c1-8-6-15-11(7-16-12(15)14-8)9-2-4-10(13)5-3-9;/h2-5,7-8H,6H2,1H3;1H.
What are the key properties of 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide?
3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide has a molecular weight of 331.67 g/mol, XLogP of 4.02, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide is sourced from PubChem (CID 23723163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).