N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide

C18H14ClFN2O4S — CID 9146107

IUPACN-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1F)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C18H14ClFN2O4S/c19-15-4-1-5-16(17(15)20)22-18(23)12-6-8-14(9-7-12)27(24,25)21-11-13-3-2-10-26-13/h1-10,21H,11H2,(H,22,23)
InChIKeyLYUSSLNOKWMUQD-UHFFFAOYSA-N
MW408.84 g/mol
LogP3.80
Rot. Bonds6

About N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide

N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide (PubChem CID 9146107) has the molecular formula C18H14ClFN2O4S and a molecular weight of 408.84 g/mol. Its IUPAC name is N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
PubChem CID9146107
Molecular FormulaC18H14ClFN2O4S
Molecular Weight408.84 g/mol
Exact Mass408.03
IUPAC NameN-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1F)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C18H14ClFN2O4S/c19-15-4-1-5-16(17(15)20)22-18(23)12-6-8-14(9-7-12)27(24,25)21-11-13-3-2-10-26-13/h1-10,21H,11H2,(H,22,23)
InChIKeyLYUSSLNOKWMUQD-UHFFFAOYSA-N
XLogP3.80
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.84
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloro-4-methylphenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 4789763
N-(4-chlorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 2687824
4-(furan-2-ylmethylsulfamoyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzamide
CID 18274021
3-chloro-N-[2-fluoro-4-(furan-2-ylmethylsulfamoyl)phenyl]benzamide
CID 18892761
N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 9165761
N-(5-chloro-2-methoxyphenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 4793263
N-(2-fluorophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide
CID 24639632
N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 38760567
4-(furan-2-ylmethylsulfamoyl)-N-[3-(2-methylpropanoylamino)phenyl]benzamide
CID 55617154
4-fluoro-N-[[4-(furan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]benzamide
CID 17171054
4-(furan-2-ylmethylsulfamoyl)-N-(2-methyl-5-nitrophenyl)benzamide
CID 55347552
N-[2-(4-chlorophenyl)ethyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 9217544

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
The IUPAC name of N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide (CID 9146107) is N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
The canonical SMILES for N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide is O=C(Nc1cccc(Cl)c1F)c1ccc(S(=O)(=O)NCc2ccco2)cc1.
What is the InChIKey of N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
The InChIKey is LYUSSLNOKWMUQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClFN2O4S/c19-15-4-1-5-16(17(15)20)22-18(23)12-6-8-14(9-7-12)27(24,25)21-11-13-3-2-10-26-13/h1-10,21H,11H2,(H,22,23).
What are the key properties of N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide has a molecular weight of 408.84 g/mol, XLogP of 3.80, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 9146107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).