N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride

C21H18Cl2N4O2S — CID 146063269

About N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride

N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride (PubChem CID 146063269) has the molecular formula C21H18Cl2N4O2S and a molecular weight of 461.37 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride.

Molecular Properties

• Compound Name: N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride
• PubChem CID: 146063269
• Molecular Formula: C21H18Cl2N4O2S
• Molecular Weight: 461.37 g/mol
• Exact Mass: 460.05
• IUPAC Name: N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride
• SMILES: CC(=O)Nc1ccc(NC(=O)Cc2csc3nc(-c4ccc(Cl)cc4)cn23)cc1.Cl
• InChI: InChI=1S/C21H17ClN4O2S.ClH/c1-13(27)23-16-6-8-17(9-7-16)24-20(28)10-18-12-29-21-25-19(11-26(18)21)14-2-4-15(22)5-3-14;/h2-9,11-12H,10H2,1H3,(H,23,27)(H,24,28);1H
• InChIKey: JELDYQOENJPRKF-UHFFFAOYSA-N
• XLogP: 5.28
• TPSA: 75.50 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	461.37
LogP ≤ 5	5.28
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride?

The IUPAC name of N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride (CID 146063269) is N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride.

What is the SMILES notation for N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride?

The canonical SMILES for N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride is CC(=O)Nc1ccc(NC(=O)Cc2csc3nc(-c4ccc(Cl)cc4)cn23)cc1.Cl.

What is the InChIKey of N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride?

The InChIKey is JELDYQOENJPRKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN4O2S.ClH/c1-13(27)23-16-6-8-17(9-7-16)24-20(28)10-18-12-29-21-25-19(11-26(18)21)14-2-4-15(22)5-3-14;/h2-9,11-12H,10H2,1H3,(H,23,27)(H,24,28);1H.

What are the key properties of N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride?

N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride has a molecular weight of 461.37 g/mol, XLogP of 5.28, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-acetamidophenyl)-2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide;hydrochloride is sourced from PubChem (CID 146063269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).