4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide

C15H16ClN3O3S — CID 60532248

IUPAC4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide
SMILESCN(C)c1c(Cl)cccc1NS(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C15H16ClN3O3S/c1-19(2)14-12(16)4-3-5-13(14)18-23(21,22)11-8-6-10(7-9-11)15(17)20/h3-9,18H,1-2H3,(H2,17,20)
InChIKeyUPNZTTGFDZXCJB-UHFFFAOYSA-N
MW353.83 g/mol
LogP2.31
Rot. Bonds5

About 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide

4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide (PubChem CID 60532248) has the molecular formula C15H16ClN3O3S and a molecular weight of 353.83 g/mol. Its IUPAC name is 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide
PubChem CID60532248
Molecular FormulaC15H16ClN3O3S
Molecular Weight353.83 g/mol
Exact Mass353.06
IUPAC Name4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide
SMILESCN(C)c1c(Cl)cccc1NS(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C15H16ClN3O3S/c1-19(2)14-12(16)4-3-5-13(14)18-23(21,22)11-8-6-10(7-9-11)15(17)20/h3-9,18H,1-2H3,(H2,17,20)
InChIKeyUPNZTTGFDZXCJB-UHFFFAOYSA-N
XLogP2.31
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.83
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(3-chloro-2-methylphenyl)sulfamoyl]benzamide
CID 51263313
4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide
CID 60578962
3-chloro-N-[3-chloro-2-(dimethylamino)phenyl]-4-methoxybenzenesulfonamide
CID 60532106
4-acetyl-N-(3-chloro-2-methylphenyl)benzenesulfonamide
CID 7938770
N-[3-chloro-2-(dimethylamino)phenyl]-2-methylbenzenesulfonamide
CID 62997649
4-[(2-piperidin-1-ylphenyl)sulfamoyl]benzamide
CID 51263382
4-[(2-chlorophenyl)sulfamoyl]-N-[2-(dimethylamino)ethyl]benzamide
CID 4793513
3-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]propanoic acid
CID 43699684
4-[(4-chlorophenyl)sulfamoyl]benzamide
CID 27187051
4-[(3-chloro-2-methylphenyl)sulfamoyl]-N-cyclopropylbenzamide
CID 109058337
4-(1,2-dihydroacenaphthylen-5-ylsulfamoyl)benzamide
CID 51284207
4-[(3-methylsulfonylphenyl)sulfamoyl]benzamide
CID 18286126

Frequently Asked Questions

What is the IUPAC name of 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide?
The IUPAC name of 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide (CID 60532248) is 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide.
What is the SMILES notation for 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide?
The canonical SMILES for 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide is CN(C)c1c(Cl)cccc1NS(=O)(=O)c1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide?
The InChIKey is UPNZTTGFDZXCJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O3S/c1-19(2)14-12(16)4-3-5-13(14)18-23(21,22)11-8-6-10(7-9-11)15(17)20/h3-9,18H,1-2H3,(H2,17,20).
What are the key properties of 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide?
4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide has a molecular weight of 353.83 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide is sourced from PubChem (CID 60532248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).