3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide

C18H20N4O4S — CID 26701226

IUPAC3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
SMILESCc1cc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc(S(=O)(=O)N(C)C)c1C
InChIInChI=1S/C18H20N4O4S/c1-10-7-12(8-16(11(10)2)27(25,26)22(3)4)17(23)19-13-5-6-14-15(9-13)21-18(24)20-14/h5-9H,1-4H3,(H,19,23)(H2,20,21,24)
InChIKeyPDEHHAPLCVZTEG-UHFFFAOYSA-N
MW388.45 g/mol
LogP1.98
Rot. Bonds4

About 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide

3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide (PubChem CID 26701226) has the molecular formula C18H20N4O4S and a molecular weight of 388.45 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
PubChem CID26701226
Molecular FormulaC18H20N4O4S
Molecular Weight388.45 g/mol
Exact Mass388.12
IUPAC Name3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
SMILESCc1cc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc(S(=O)(=O)N(C)C)c1C
InChIInChI=1S/C18H20N4O4S/c1-10-7-12(8-16(11(10)2)27(25,26)22(3)4)17(23)19-13-5-6-14-15(9-13)21-18(24)20-14/h5-9H,1-4H3,(H,19,23)(H2,20,21,24)
InChIKeyPDEHHAPLCVZTEG-UHFFFAOYSA-N
XLogP1.98
TPSA115.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.45
LogP ≤ 51.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-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

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide (CID 26701226) is 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide is Cc1cc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc(S(=O)(=O)N(C)C)c1C.
What is the InChIKey of 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide?
The InChIKey is PDEHHAPLCVZTEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O4S/c1-10-7-12(8-16(11(10)2)27(25,26)22(3)4)17(23)19-13-5-6-14-15(9-13)21-18(24)20-14/h5-9H,1-4H3,(H,19,23)(H2,20,21,24).
What are the key properties of 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide?
3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide has a molecular weight of 388.45 g/mol, XLogP of 1.98, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide is sourced from PubChem (CID 26701226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).