4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide

C18H20N4O4S — CID 110400751

IUPAC4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)NCCn2c(=O)[nH]c3ccccc32)cc1
InChIInChI=1S/C18H20N4O4S/c1-21(2)27(25,26)14-9-7-13(8-10-14)17(23)19-11-12-22-16-6-4-3-5-15(16)20-18(22)24/h3-10H,11-12H2,1-2H3,(H,19,23)(H,20,24)
InChIKeyUVZQBSPQSURNNH-UHFFFAOYSA-N
MW388.45 g/mol
LogP1.01
Rot. Bonds6

About 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide

4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide (PubChem CID 110400751) has the molecular formula C18H20N4O4S and a molecular weight of 388.45 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide
PubChem CID110400751
Molecular FormulaC18H20N4O4S
Molecular Weight388.45 g/mol
Exact Mass388.12
IUPAC Name4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)NCCn2c(=O)[nH]c3ccccc32)cc1
InChIInChI=1S/C18H20N4O4S/c1-21(2)27(25,26)14-9-7-13(8-10-14)17(23)19-11-12-22-16-6-4-3-5-15(16)20-18(22)24/h3-10H,11-12H2,1-2H3,(H,19,23)(H,20,24)
InChIKeyUVZQBSPQSURNNH-UHFFFAOYSA-N
XLogP1.01
TPSA104.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.45
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]benzamide
CID 110419732
N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]-4-pyrrolidin-1-ylbenzamide
CID 110417561
4-(dimethylsulfamoyl)-N-(2-pyrrol-1-ylethyl)benzamide
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3-methoxy-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide
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N-[2-(2,3-dioxo-4H-quinoxalin-1-yl)ethyl]-4-methylbenzamide
CID 110396409
4-(dimethylsulfamoyl)-N-(3-indol-1-ylpropyl)benzamide
CID 2489290
3-(2-oxo-3H-benzimidazol-1-yl)propyl 3-(dimethylsulfamoyl)benzoate
CID 2685845
2-(dimethylamino)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]-2-phenylacetamide
CID 110610901
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(dimethylsulfamoyl)benzamide
CID 4825744
4-(dimethylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645316
3-methoxy-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]benzamide
CID 110419698
3,4,5-trimethoxy-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]benzamide
CID 110419706

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide (CID 110400751) is 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide is CN(C)S(=O)(=O)c1ccc(C(=O)NCCn2c(=O)[nH]c3ccccc32)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide?
The InChIKey is UVZQBSPQSURNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O4S/c1-21(2)27(25,26)14-9-7-13(8-10-14)17(23)19-11-12-22-16-6-4-3-5-15(16)20-18(22)24/h3-10H,11-12H2,1-2H3,(H,19,23)(H,20,24).
What are the key properties of 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide?
4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide has a molecular weight of 388.45 g/mol, XLogP of 1.01, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide is sourced from PubChem (CID 110400751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).