4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride

C11H9BrClN2OS- — CID 53314151

IUPAC4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride
SMILESOc1ccc(Br)cc1C1=CSC2=NCCN12.[Cl-]
InChIInChI=1S/C11H9BrN2OS.ClH/c12-7-1-2-10(15)8(5-7)9-6-16-11-13-3-4-14(9)11;/h1-2,5-6,15H,3-4H2;1H/p-1
InChIKeyTXRHDKCVBACQFW-UHFFFAOYSA-M
MW332.63 g/mol
LogP-0.12
Rot. Bonds1

About 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride

4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride (PubChem CID 53314151) has the molecular formula C11H9BrClN2OS- and a molecular weight of 332.63 g/mol. Its IUPAC name is 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride.

Molecular Properties

Compound Name4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride
PubChem CID53314151
Molecular FormulaC11H9BrClN2OS-
Molecular Weight332.63 g/mol
Exact Mass330.93
IUPAC Name4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride
SMILESOc1ccc(Br)cc1C1=CSC2=NCCN12.[Cl-]
InChIInChI=1S/C11H9BrN2OS.ClH/c12-7-1-2-10(15)8(5-7)9-6-16-11-13-3-4-14(9)11;/h1-2,5-6,15H,3-4H2;1H/p-1
InChIKeyTXRHDKCVBACQFW-UHFFFAOYSA-M
XLogP-0.12
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.63
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Phenol, 4-bromo-2-(5,6-dihydroimidazo(2,1-b)thiazol-3-yl)-, monohydrochloride
CID 3074656
Imidazo(2,1-b)thiazole, 5,6-dihydro-3-(5-bromo-2-propoxyphenyl)-, monohydrochloride
CID 2843855
4-Bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol
CID 658058
3-(5-Bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 1612034
3-(5-Bromo-2-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 2857481
4-(5,6-Dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol;hydrobromide
CID 24190780
4-Bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol;hydron;chloride
CID 658057
2-(5,6-Dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol
CID 11608222
2-(5,6-Dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol
CID 11658692
methyl N'-[(5-bromo-2-hydroxyphenyl)methyl]-N-(1-hydroxyethyl)-N-methylcarbamimidothioate
CID 163670093
4-[[(5-bromo-2-hydroxyphenyl)methylamino]methyl]-3H-1,3-thiazol-2-one
CID 106379736

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride?
The IUPAC name of 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride (CID 53314151) is 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride.
What is the SMILES notation for 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride?
The canonical SMILES for 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride is Oc1ccc(Br)cc1C1=CSC2=NCCN12.[Cl-].
What is the InChIKey of 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride?
The InChIKey is TXRHDKCVBACQFW-UHFFFAOYSA-M. The full InChI is InChI=1S/C11H9BrN2OS.ClH/c12-7-1-2-10(15)8(5-7)9-6-16-11-13-3-4-14(9)11;/h1-2,5-6,15H,3-4H2;1H/p-1.
What are the key properties of 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride?
4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride has a molecular weight of 332.63 g/mol, XLogP of -0.12, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride is sourced from PubChem (CID 53314151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).