4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide

C15H15ClN2O4S — CID 60578962

IUPAC4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide
SMILESCCOc1c(Cl)cccc1NS(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C15H15ClN2O4S/c1-2-22-14-12(16)4-3-5-13(14)18-23(20,21)11-8-6-10(7-9-11)15(17)19/h3-9,18H,2H2,1H3,(H2,17,19)
InChIKeyLDMRVGYBJRDYFX-UHFFFAOYSA-N
MW354.82 g/mol
LogP2.64
Rot. Bonds6

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

4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide (PubChem CID 60578962) has the molecular formula C15H15ClN2O4S and a molecular weight of 354.82 g/mol. Its IUPAC name is 4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide
PubChem CID60578962
Molecular FormulaC15H15ClN2O4S
Molecular Weight354.82 g/mol
Exact Mass354.04
IUPAC Name4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide
SMILESCCOc1c(Cl)cccc1NS(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C15H15ClN2O4S/c1-2-22-14-12(16)4-3-5-13(14)18-23(20,21)11-8-6-10(7-9-11)15(17)19/h3-9,18H,2H2,1H3,(H2,17,19)
InChIKeyLDMRVGYBJRDYFX-UHFFFAOYSA-N
XLogP2.64
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.82
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-2-ethoxyphenyl)-4-methylbenzenesulfonamide
CID 169370534
4-[(3-chloro-2-methylphenyl)sulfamoyl]benzamide
CID 51263313
4-[[3-chloro-2-(dimethylamino)phenyl]sulfamoyl]benzamide
CID 60532248
4-(1,2-dihydroacenaphthylen-5-ylsulfamoyl)benzamide
CID 51284207
(3-chloro-2-ethoxyphenyl)hydrazine
CID 130779145
4-(1H-indazol-4-ylsulfamoyl)benzamide
CID 60524919
4-acetyl-N-(3-chloro-2-methylphenyl)benzenesulfonamide
CID 7938770
N-(3-chloro-2-ethoxyphenyl)-2,3-dimethyl-5-nitrobenzenesulfonamide
CID 60579062
4-[[4-ethoxy-3-(hydroxymethyl)phenyl]sulfamoyl]benzamide
CID 47059390
4-[(2-piperidin-1-ylphenyl)sulfamoyl]benzamide
CID 51263382
2-[(3,4-diethoxyphenyl)sulfonylamino]benzamide
CID 9055880
2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 35546601

Frequently Asked Questions

What is the IUPAC name of 4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide?
The IUPAC name of 4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide (CID 60578962) is 4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide.
What is the SMILES notation for 4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide?
The canonical SMILES for 4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide is CCOc1c(Cl)cccc1NS(=O)(=O)c1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide?
The InChIKey is LDMRVGYBJRDYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O4S/c1-2-22-14-12(16)4-3-5-13(14)18-23(20,21)11-8-6-10(7-9-11)15(17)19/h3-9,18H,2H2,1H3,(H2,17,19).
What are the key properties of 4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide?
4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide has a molecular weight of 354.82 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-chloro-2-ethoxyphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 60578962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).