N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide

C19H16N2O4S — CID 2474450

IUPACN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide
SMILESCC(=O)c1ccc(-c2ccc(C(=O)Nc3nc(C)c(C(C)=O)s3)o2)cc1
InChIInChI=1S/C19H16N2O4S/c1-10-17(12(3)23)26-19(20-10)21-18(24)16-9-8-15(25-16)14-6-4-13(5-7-14)11(2)22/h4-9H,1-3H3,(H,20,21,24)
InChIKeyNKVDTFBALLSIHU-UHFFFAOYSA-N
MW368.41 g/mol
LogP4.37
Rot. Bonds5

About N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide

N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide (PubChem CID 2474450) has the molecular formula C19H16N2O4S and a molecular weight of 368.41 g/mol. Its IUPAC name is N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide
PubChem CID2474450
Molecular FormulaC19H16N2O4S
Molecular Weight368.41 g/mol
Exact Mass368.08
IUPAC NameN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide
SMILESCC(=O)c1ccc(-c2ccc(C(=O)Nc3nc(C)c(C(C)=O)s3)o2)cc1
InChIInChI=1S/C19H16N2O4S/c1-10-17(12(3)23)26-19(20-10)21-18(24)16-9-8-15(25-16)14-6-4-13(5-7-14)11(2)22/h4-9H,1-3H3,(H,20,21,24)
InChIKeyNKVDTFBALLSIHU-UHFFFAOYSA-N
XLogP4.37
TPSA89.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.41
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide?
The IUPAC name of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide (CID 2474450) is N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide.
What is the SMILES notation for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide?
The canonical SMILES for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide is CC(=O)c1ccc(-c2ccc(C(=O)Nc3nc(C)c(C(C)=O)s3)o2)cc1.
What is the InChIKey of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide?
The InChIKey is NKVDTFBALLSIHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O4S/c1-10-17(12(3)23)26-19(20-10)21-18(24)16-9-8-15(25-16)14-6-4-13(5-7-14)11(2)22/h4-9H,1-3H3,(H,20,21,24).
What are the key properties of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide?
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide has a molecular weight of 368.41 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(4-acetylphenyl)furan-2-carboxamide is sourced from PubChem (CID 2474450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).