4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide

C20H20N2O3S2 — CID 6503694

IUPAC4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
SMILESCc1cccc(N(C)S(=O)(=O)c2csc(C(=O)Nc3ccccc3C)c2)c1
InChIInChI=1S/C20H20N2O3S2/c1-14-7-6-9-16(11-14)22(3)27(24,25)17-12-19(26-13-17)20(23)21-18-10-5-4-8-15(18)2/h4-13H,1-3H3,(H,21,23)
InChIKeyNLNVRMKSVQABSI-UHFFFAOYSA-N
MW400.53 g/mol
LogP4.44
Rot. Bonds5

About 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide

4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide (PubChem CID 6503694) has the molecular formula C20H20N2O3S2 and a molecular weight of 400.53 g/mol. Its IUPAC name is 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
PubChem CID6503694
Molecular FormulaC20H20N2O3S2
Molecular Weight400.53 g/mol
Exact Mass400.09
IUPAC Name4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
SMILESCc1cccc(N(C)S(=O)(=O)c2csc(C(=O)Nc3ccccc3C)c2)c1
InChIInChI=1S/C20H20N2O3S2/c1-14-7-6-9-16(11-14)22(3)27(24,25)17-12-19(26-13-17)20(23)21-18-10-5-4-8-15(18)2/h4-13H,1-3H3,(H,21,23)
InChIKeyNLNVRMKSVQABSI-UHFFFAOYSA-N
XLogP4.44
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.53
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-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

Related Compounds

4-(dimethylsulfamoyl)-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6503064
N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide
CID 6504099
N-(2,4-dimethylphenyl)-4-(dimethylsulfamoyl)thiophene-2-carboxamide
CID 6503076
N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide
CID 6504111
4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide
CID 6503102
4-(cyclopentylsulfamoyl)-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6504119
4-[(4-hydroxyphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6504088
4-(dimethylsulfamoyl)-N-(2-methoxyphenyl)thiophene-2-carboxamide
CID 6503057
N-(2,4-dimethylphenyl)-4-[2-methoxyethyl(methyl)sulfamoyl]thiophene-2-carboxamide
CID 6503852
4-[methyl(phenyl)sulfamoyl]thiophene-2-carboxamide
CID 851375
4-[methyl(phenyl)sulfamoyl]thiophene-2-carboxylate
CID 6949945
4-methyl-3-[[4-[(2-methylphenyl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid
CID 22307959

Frequently Asked Questions

What is the IUPAC name of 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide?
The IUPAC name of 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide (CID 6503694) is 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide is Cc1cccc(N(C)S(=O)(=O)c2csc(C(=O)Nc3ccccc3C)c2)c1.
What is the InChIKey of 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide?
The InChIKey is NLNVRMKSVQABSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3S2/c1-14-7-6-9-16(11-14)22(3)27(24,25)17-12-19(26-13-17)20(23)21-18-10-5-4-8-15(18)2/h4-13H,1-3H3,(H,21,23).
What are the key properties of 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide?
4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide has a molecular weight of 400.53 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 6503694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).