N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide

C20H18ClN3O2S — CID 42793061

About N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide

N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide (PubChem CID 42793061) has the molecular formula C20H18ClN3O2S and a molecular weight of 399.90 g/mol. Its IUPAC name is N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

• Compound Name: N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide
• PubChem CID: 42793061
• Molecular Formula: C20H18ClN3O2S
• Molecular Weight: 399.90 g/mol
• Exact Mass: 399.08
• IUPAC Name: N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide
• SMILES: CC(=O)N(CCc1csc2nc(-c3ccc(Cl)cc3)cn12)Cc1ccco1
• InChI: InChI=1S/C20H18ClN3O2S/c1-14(25)23(11-18-3-2-10-26-18)9-8-17-13-27-20-22-19(12-24(17)20)15-4-6-16(21)7-5-15/h2-7,10,12-13H,8-9,11H2,1H3
• InChIKey: ACURZGMJJNHHEN-UHFFFAOYSA-N
• XLogP: 4.90
• TPSA: 50.75 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	399.90
LogP ≤ 5	4.90
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide (CID 42793061) is N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide.

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

The canonical SMILES for N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide is CC(=O)N(CCc1csc2nc(-c3ccc(Cl)cc3)cn12)Cc1ccco1.

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

The InChIKey is ACURZGMJJNHHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2S/c1-14(25)23(11-18-3-2-10-26-18)9-8-17-13-27-20-22-19(12-24(17)20)15-4-6-16(21)7-5-15/h2-7,10,12-13H,8-9,11H2,1H3.

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

N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide has a molecular weight of 399.90 g/mol, XLogP of 4.90, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]ethyl]-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 42793061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).