N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide

C21H18ClFN2O3S — CID 3348242

IUPACN-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1)c1cc(S(=O)(=O)NCCc2ccccc2)ccc1F
InChIInChI=1S/C21H18ClFN2O3S/c22-16-7-4-8-17(13-16)25-21(26)19-14-18(9-10-20(19)23)29(27,28)24-12-11-15-5-2-1-3-6-15/h1-10,13-14,24H,11-12H2,(H,25,26)
InChIKeyGGBVCFRVKITRFL-UHFFFAOYSA-N
MW432.90 g/mol
LogP4.25
Rot. Bonds7

About N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide

N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide (PubChem CID 3348242) has the molecular formula C21H18ClFN2O3S and a molecular weight of 432.90 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide
PubChem CID3348242
Molecular FormulaC21H18ClFN2O3S
Molecular Weight432.90 g/mol
Exact Mass432.07
IUPAC NameN-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1)c1cc(S(=O)(=O)NCCc2ccccc2)ccc1F
InChIInChI=1S/C21H18ClFN2O3S/c22-16-7-4-8-17(13-16)25-21(26)19-14-18(9-10-20(19)23)29(27,28)24-12-11-15-5-2-1-3-6-15/h1-10,13-14,24H,11-12H2,(H,25,26)
InChIKeyGGBVCFRVKITRFL-UHFFFAOYSA-N
XLogP4.25
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.90
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-fluorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide
CID 4125899
N-(3-chloro-2-methylphenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide
CID 15994437
2-fluoro-N-(2-methoxyphenyl)-5-(2-phenylethylsulfamoyl)benzamide
CID 5070664
N-(3-fluorophenyl)-3-(2-phenylethylsulfamoyl)benzamide
CID 109064976
2-fluoro-N-(3-methylphenyl)-5-(propylsulfamoyl)benzamide
CID 5056641
N-(5-chloro-2-methoxyphenyl)-5-[2-(4-chlorophenyl)ethylsulfamoyl]-2-fluorobenzamide
CID 4611034
N-(2,5-dimethoxyphenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide
CID 4609696
4-chloro-N-[4-(2-phenylethylsulfamoyl)phenyl]benzamide
CID 4110983
N-(3-chlorophenyl)-5-(cyclohexylsulfamoyl)-2-fluorobenzamide
CID 90075218
N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide
CID 26578624
N-[2-(3-chlorophenyl)ethyl]-4-fluorobenzenesulfonamide
CID 897615
4-bromo-N-[2-(3-chlorophenyl)ethyl]-3-fluorobenzenesulfonamide
CID 107650102

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide?
The IUPAC name of N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide (CID 3348242) is N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide?
The canonical SMILES for N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide is O=C(Nc1cccc(Cl)c1)c1cc(S(=O)(=O)NCCc2ccccc2)ccc1F.
What is the InChIKey of N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide?
The InChIKey is GGBVCFRVKITRFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClFN2O3S/c22-16-7-4-8-17(13-16)25-21(26)19-14-18(9-10-20(19)23)29(27,28)24-12-11-15-5-2-1-3-6-15/h1-10,13-14,24H,11-12H2,(H,25,26).
What are the key properties of N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide?
N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide has a molecular weight of 432.90 g/mol, XLogP of 4.25, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide is sourced from PubChem (CID 3348242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).