N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide

C18H14F2N2O4S — CID 9165761

IUPACN-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C18H14F2N2O4S/c19-16-8-5-13(10-17(16)20)22-18(23)12-3-6-15(7-4-12)27(24,25)21-11-14-2-1-9-26-14/h1-10,21H,11H2,(H,22,23)
InChIKeyCPIGSWNQZHJDET-UHFFFAOYSA-N
MW392.38 g/mol
LogP3.29
Rot. Bonds6

About N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide

N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide (PubChem CID 9165761) has the molecular formula C18H14F2N2O4S and a molecular weight of 392.38 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
PubChem CID9165761
Molecular FormulaC18H14F2N2O4S
Molecular Weight392.38 g/mol
Exact Mass392.06
IUPAC NameN-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C18H14F2N2O4S/c19-16-8-5-13(10-17(16)20)22-18(23)12-3-6-15(7-4-12)27(24,25)21-11-14-2-1-9-26-14/h1-10,21H,11H2,(H,22,23)
InChIKeyCPIGSWNQZHJDET-UHFFFAOYSA-N
XLogP3.29
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.38
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-difluorophenyl)-2-fluoro-5-(furan-2-ylmethylsulfamoyl)benzamide
CID 4115156
N-(4-chlorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 2687824
N-(2,3-dihydro-1H-inden-5-yl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 26864849
4-(furan-2-ylmethylsulfamoyl)-N-[3-(2-methylpropanoylamino)phenyl]benzamide
CID 55617154
4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide
CID 55567977
N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-4-(trifluoromethyl)benzamide
CID 24639746
3-bromo-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-4-methylbenzamide
CID 17170937
4-fluoro-N-[[4-(furan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]benzamide
CID 17171054
N-[3-(cyclopropylsulfamoyl)phenyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 24584102
N-[3-(diethylsulfamoyl)-4-methylphenyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 5147041
4-fluoro-3-(furan-2-ylmethylsulfamoyl)-N-(3-methylphenyl)benzamide
CID 3435304
[2-(3-fluoro-4-methylanilino)-2-oxoethyl] 4-(furan-2-ylmethylsulfamoyl)benzoate
CID 2550017

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
The IUPAC name of N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide (CID 9165761) is N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
The canonical SMILES for N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide is O=C(Nc1ccc(F)c(F)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1.
What is the InChIKey of N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
The InChIKey is CPIGSWNQZHJDET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N2O4S/c19-16-8-5-13(10-17(16)20)22-18(23)12-3-6-15(7-4-12)27(24,25)21-11-14-2-1-9-26-14/h1-10,21H,11H2,(H,22,23).
What are the key properties of N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide has a molecular weight of 392.38 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 9165761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).