N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide

C17H16FN3O4S2 — CID 59362182

IUPACN-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(C)c(-c2ccc(S(=O)(=O)NCc3cccc(F)c3)o2)s1
InChIInChI=1S/C17H16FN3O4S2/c1-10-16(26-17(20-10)21-11(2)22)14-6-7-15(25-14)27(23,24)19-9-12-4-3-5-13(18)8-12/h3-8,19H,9H2,1-2H3,(H,20,21,22)
InChIKeyJULDMDFXTLVIKW-UHFFFAOYSA-N
MW409.46 g/mol
LogP3.29
Rot. Bonds6

About N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide

N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide (PubChem CID 59362182) has the molecular formula C17H16FN3O4S2 and a molecular weight of 409.46 g/mol. Its IUPAC name is N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
PubChem CID59362182
Molecular FormulaC17H16FN3O4S2
Molecular Weight409.46 g/mol
Exact Mass409.06
IUPAC NameN-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(C)c(-c2ccc(S(=O)(=O)NCc3cccc(F)c3)o2)s1
InChIInChI=1S/C17H16FN3O4S2/c1-10-16(26-17(20-10)21-11(2)22)14-6-7-15(25-14)27(23,24)19-9-12-4-3-5-13(18)8-12/h3-8,19H,9H2,1-2H3,(H,20,21,22)
InChIKeyJULDMDFXTLVIKW-UHFFFAOYSA-N
XLogP3.29
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.46
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide 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

N-[5-[5-[(3-hydroxyphenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;molecular hydrogen
CID 160781972
N-[5-[5-[(3-iodophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;molecular hydrogen
CID 159514639
N-[5-[5-[(3,5-dichlorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 59362171
N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 59362205
N-[4-methyl-5-(5-methylsulfonylfuran-2-yl)-1,3-thiazol-2-yl]acetamide
CID 143638089
N-[5-[5-[benzyl(methyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;molecular hydrogen
CID 158251335
N-[5-[5-[[cyano(phenyl)methyl]sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 59362186
N-[5-[6-chloro-5-[(4-fluorophenyl)sulfonyl-methylamino]-3-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 87177223
3-fluoro-N-[(3-fluorophenyl)methyl]benzenesulfonamide
CID 25046873
2-(3-fluorophenyl)-N-[2-[(4-methyl-5-phenyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]acetamide
CID 55851828
2-chloro-N-[(3-fluorophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 91820954
N-[5-[3-(2-hydroxyethylsulfamoyl)phenyl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 87061286

Frequently Asked Questions

What is the IUPAC name of N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide (CID 59362182) is N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1nc(C)c(-c2ccc(S(=O)(=O)NCc3cccc(F)c3)o2)s1.
What is the InChIKey of N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide?
The InChIKey is JULDMDFXTLVIKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O4S2/c1-10-16(26-17(20-10)21-11(2)22)14-6-7-15(25-14)27(23,24)19-9-12-4-3-5-13(18)8-12/h3-8,19H,9H2,1-2H3,(H,20,21,22).
What are the key properties of N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide?
N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide has a molecular weight of 409.46 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 59362182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).