N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide

C20H15F2N3OS — CID 24554891

IUPACN-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
SMILESCc1ccc(NC(=O)Cc2csc3nc(-c4ccc(F)cc4)cn23)cc1F
InChIInChI=1S/C20H15F2N3OS/c1-12-2-7-15(8-17(12)22)23-19(26)9-16-11-27-20-24-18(10-25(16)20)13-3-5-14(21)6-4-13/h2-8,10-11H,9H2,1H3,(H,23,26)
InChIKeyQXMONTPHYQHKBI-UHFFFAOYSA-N
MW383.42 g/mol
LogP4.83
Rot. Bonds4

About N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide

N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide (PubChem CID 24554891) has the molecular formula C20H15F2N3OS and a molecular weight of 383.42 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
PubChem CID24554891
Molecular FormulaC20H15F2N3OS
Molecular Weight383.42 g/mol
Exact Mass383.09
IUPAC NameN-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
SMILESCc1ccc(NC(=O)Cc2csc3nc(-c4ccc(F)cc4)cn23)cc1F
InChIInChI=1S/C20H15F2N3OS/c1-12-2-7-15(8-17(12)22)23-19(26)9-16-11-27-20-24-18(10-25(16)20)13-3-5-14(21)6-4-13/h2-8,10-11H,9H2,1H3,(H,23,26)
InChIKeyQXMONTPHYQHKBI-UHFFFAOYSA-N
XLogP4.83
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.42
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide (CID 24554891) is N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide is Cc1ccc(NC(=O)Cc2csc3nc(-c4ccc(F)cc4)cn23)cc1F.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide?
The InChIKey is QXMONTPHYQHKBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N3OS/c1-12-2-7-15(8-17(12)22)23-19(26)9-16-11-27-20-24-18(10-25(16)20)13-3-5-14(21)6-4-13/h2-8,10-11H,9H2,1H3,(H,23,26).
What are the key properties of N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide?
N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide has a molecular weight of 383.42 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methylphenyl)-2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide is sourced from PubChem (CID 24554891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).