2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine

C9H6BrClN2S — CID 130836009

IUPAC2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine
SMILESNc1csc(-c2cc(Br)ccc2Cl)n1
InChIInChI=1S/C9H6BrClN2S/c10-5-1-2-7(11)6(3-5)9-13-8(12)4-14-9/h1-4H,12H2
InChIKeyRWNBAFLDSIXLBX-UHFFFAOYSA-N
MW289.59 g/mol
LogP3.81
Rot. Bonds1

About 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine

2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine (PubChem CID 130836009) has the molecular formula C9H6BrClN2S and a molecular weight of 289.59 g/mol. Its IUPAC name is 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine
PubChem CID130836009
Molecular FormulaC9H6BrClN2S
Molecular Weight289.59 g/mol
Exact Mass287.91
IUPAC Name2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine
SMILESNc1csc(-c2cc(Br)ccc2Cl)n1
InChIInChI=1S/C9H6BrClN2S/c10-5-1-2-7(11)6(3-5)9-13-8(12)4-14-9/h1-4H,12H2
InChIKeyRWNBAFLDSIXLBX-UHFFFAOYSA-N
XLogP3.81
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.59
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine 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

2-(5-bromo-2-methylphenyl)-1,3-thiazol-4-amine
CID 116864241
2-(5-bromo-2-fluorophenyl)-4-chloro-1,3-thiazole
CID 83158213
2-(4-chloro-3-propan-2-ylphenyl)-1,3-thiazol-4-amine
CID 145049362
3-(5-bromo-2-chlorophenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 55078987
2-[5-(5-bromo-2-chlorophenyl)-1,2,4-oxadiazol-3-yl]propan-2-amine
CID 61325051
2-(5-bromo-2-chlorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79820972
2-(3-bromo-4-methylphenyl)-1,3-thiazol-4-amine
CID 107916044
5-bromo-2-(5-bromo-2-chlorophenyl)-1,3-benzoxazole
CID 169336838
4-bromo-2-(5-bromo-2-methylphenyl)-1,3-thiazole
CID 116892245
2-(5-bromo-2-fluorophenyl)-4-(2-chloroethyl)-1,3-thiazole
CID 116889010
2-[4-(5-bromo-2-fluorophenyl)-1,3-thiazol-2-yl]aniline
CID 82966780
2-(5-bromo-2-chlorophenyl)-5-iodo-6-methylpyrimidin-4-amine
CID 114077251

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine?
The IUPAC name of 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine (CID 130836009) is 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine.
What is the SMILES notation for 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine?
The canonical SMILES for 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine is Nc1csc(-c2cc(Br)ccc2Cl)n1.
What is the InChIKey of 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine?
The InChIKey is RWNBAFLDSIXLBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6BrClN2S/c10-5-1-2-7(11)6(3-5)9-13-8(12)4-14-9/h1-4H,12H2.
What are the key properties of 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine?
2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine has a molecular weight of 289.59 g/mol, XLogP of 3.81, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-chlorophenyl)-1,3-thiazol-4-amine is sourced from PubChem (CID 130836009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).