4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide

C21H19ClN2O3S — CID 24635222

IUPAC4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide
SMILESO=C(NCCc1ccc(Cl)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C21H19ClN2O3S/c22-18-10-6-16(7-11-18)14-15-23-21(25)17-8-12-19(13-9-17)24-28(26,27)20-4-2-1-3-5-20/h1-13,24H,14-15H2,(H,23,25)
InChIKeyWVMGPWDZHGGLIU-UHFFFAOYSA-N
MW414.91 g/mol
LogP4.11
Rot. Bonds7

About 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide

4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide (PubChem CID 24635222) has the molecular formula C21H19ClN2O3S and a molecular weight of 414.91 g/mol. Its IUPAC name is 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide
PubChem CID24635222
Molecular FormulaC21H19ClN2O3S
Molecular Weight414.91 g/mol
Exact Mass414.08
IUPAC Name4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide
SMILESO=C(NCCc1ccc(Cl)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C21H19ClN2O3S/c22-18-10-6-16(7-11-18)14-15-23-21(25)17-8-12-19(13-9-17)24-28(26,27)20-4-2-1-3-5-20/h1-13,24H,14-15H2,(H,23,25)
InChIKeyWVMGPWDZHGGLIU-UHFFFAOYSA-N
XLogP4.11
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.91
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(benzenesulfonamido)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 31147171
4-(benzenesulfonamido)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]benzamide
CID 39548091
4-[(3-chloro-4-fluorophenyl)sulfonylamino]-N-(2-phenylethyl)benzamide
CID 43000805
N-[2-(4-chlorophenyl)ethyl]-4-(methanesulfonamido)benzamide
CID 42064223
N-[2-(4-fluorophenyl)ethyl]-4-[(4-fluorophenyl)sulfonylamino]benzamide
CID 9164370
4-[(3,4-difluorophenyl)sulfonylamino]-N-[2-(4-fluorophenyl)ethyl]benzamide
CID 27256677
N-[2-(3-chlorophenyl)ethyl]-4-[(4-fluorophenyl)sulfonylamino]benzamide
CID 46807280
4-[(3-nitrophenyl)sulfonylamino]-N-(2-phenylethyl)benzamide
CID 18108738
4-[(4-chlorophenyl)sulfamoyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide
CID 8531298
4-chloro-N-[4-(2-phenylethylsulfamoyl)phenyl]benzamide
CID 4110983
4-[(4-chlorophenyl)sulfamoyl]-N-(3-phenylprop-2-ynyl)benzamide
CID 24615549
4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-N-(2-phenylethyl)benzamide
CID 24981727

Frequently Asked Questions

What is the IUPAC name of 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide?
The IUPAC name of 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide (CID 24635222) is 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide.
What is the SMILES notation for 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide?
The canonical SMILES for 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide is O=C(NCCc1ccc(Cl)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide?
The InChIKey is WVMGPWDZHGGLIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O3S/c22-18-10-6-16(7-11-18)14-15-23-21(25)17-8-12-19(13-9-17)24-28(26,27)20-4-2-1-3-5-20/h1-13,24H,14-15H2,(H,23,25).
What are the key properties of 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide?
4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide has a molecular weight of 414.91 g/mol, XLogP of 4.11, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzenesulfonamido)-N-[2-(4-chlorophenyl)ethyl]benzamide is sourced from PubChem (CID 24635222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).