4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide

C19H19N3O5S4 — CID 24570139

IUPAC4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide
SMILESCc1ccc(-c2csc(NC(=O)c3ccc(S(=O)(=O)NC4CCS(=O)(=O)C4)cc3)n2)s1
InChIInChI=1S/C19H19N3O5S4/c1-12-2-7-17(29-12)16-10-28-19(20-16)21-18(23)13-3-5-15(6-4-13)31(26,27)22-14-8-9-30(24,25)11-14/h2-7,10,14,22H,8-9,11H2,1H3,(H,20,21,23)
InChIKeyWWWQPBVVOBMDBE-UHFFFAOYSA-N
MW497.65 g/mol
LogP2.90
Rot. Bonds6

About 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide

4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide (PubChem CID 24570139) has the molecular formula C19H19N3O5S4 and a molecular weight of 497.65 g/mol. Its IUPAC name is 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide.

Molecular Properties

Compound Name4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide
PubChem CID24570139
Molecular FormulaC19H19N3O5S4
Molecular Weight497.65 g/mol
Exact Mass497.02
IUPAC Name4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide
SMILESCc1ccc(-c2csc(NC(=O)c3ccc(S(=O)(=O)NC4CCS(=O)(=O)C4)cc3)n2)s1
InChIInChI=1S/C19H19N3O5S4/c1-12-2-7-17(29-12)16-10-28-19(20-16)21-18(23)13-3-5-15(6-4-13)31(26,27)22-14-8-9-30(24,25)11-14/h2-7,10,14,22H,8-9,11H2,1H3,(H,20,21,23)
InChIKeyWWWQPBVVOBMDBE-UHFFFAOYSA-N
XLogP2.90
TPSA122.30 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500497.65
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide 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

4-(cyclopropylsulfamoyl)-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]benzamide
CID 41189388
4-[methyl(propan-2-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide
CID 35804701
4-(2,5-dimethylpyrrol-1-yl)-N-[4-[[(3R)-1,1-dioxothiolan-3-yl]sulfamoyl]phenyl]benzamide
CID 40796098
4-(methylsulfonylmethyl)-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide
CID 42008359
4-[(1,1-dioxothiolan-3-yl)sulfamoyl]benzoic acid
CID 2858778
N-cyclopentyl-4-[(1,1-dioxothiolan-3-yl)sulfamoyl]benzamide
CID 109059272
4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-(1H-1,2,4-triazol-5-yl)benzamide
CID 42954274
4-(cyclopropylsulfamoyl)-N-(1,1-dioxothiolan-3-yl)benzamide
CID 109058398
ethyl 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]benzoate
CID 25035168
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-4-[(1,1-dioxothiolan-3-yl)sulfamoyl]benzamide
CID 24680155
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-4-[cyclopropyl(methyl)sulfamoyl]benzamide
CID 41363909
4-ethoxy-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide
CID 42008522

Frequently Asked Questions

What is the IUPAC name of 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide?
The IUPAC name of 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide (CID 24570139) is 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide.
What is the SMILES notation for 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide?
The canonical SMILES for 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide is Cc1ccc(-c2csc(NC(=O)c3ccc(S(=O)(=O)NC4CCS(=O)(=O)C4)cc3)n2)s1.
What is the InChIKey of 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide?
The InChIKey is WWWQPBVVOBMDBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O5S4/c1-12-2-7-17(29-12)16-10-28-19(20-16)21-18(23)13-3-5-15(6-4-13)31(26,27)22-14-8-9-30(24,25)11-14/h2-7,10,14,22H,8-9,11H2,1H3,(H,20,21,23).
What are the key properties of 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide?
4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide has a molecular weight of 497.65 g/mol, XLogP of 2.90, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide is sourced from PubChem (CID 24570139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).