N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide

C18H15BrN2O4S — CID 2909226

IUPACN-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(Br)cc1)c1cccc(S(=O)(=O)NCc2ccco2)c1
InChIInChI=1S/C18H15BrN2O4S/c19-14-6-8-15(9-7-14)21-18(22)13-3-1-5-17(11-13)26(23,24)20-12-16-4-2-10-25-16/h1-11,20H,12H2,(H,21,22)
InChIKeyUFFCRSXQFDXNJN-UHFFFAOYSA-N
MW435.30 g/mol
LogP3.77
Rot. Bonds6

About N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide

N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide (PubChem CID 2909226) has the molecular formula C18H15BrN2O4S and a molecular weight of 435.30 g/mol. Its IUPAC name is N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide
PubChem CID2909226
Molecular FormulaC18H15BrN2O4S
Molecular Weight435.30 g/mol
Exact Mass433.99
IUPAC NameN-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(Br)cc1)c1cccc(S(=O)(=O)NCc2ccco2)c1
InChIInChI=1S/C18H15BrN2O4S/c19-14-6-8-15(9-7-14)21-18(22)13-3-1-5-17(11-13)26(23,24)20-12-16-4-2-10-25-16/h1-11,20H,12H2,(H,21,22)
InChIKeyUFFCRSXQFDXNJN-UHFFFAOYSA-N
XLogP3.77
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.30
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethylphenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide
CID 26696313
N-(4-bromo-3-methylphenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide
CID 24639566
butyl 4-[[3-(furan-2-ylmethylsulfamoyl)benzoyl]amino]benzoate
CID 35143678
3-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide
CID 55728535
3-(furan-2-ylmethylsulfamoyl)benzoic acid
CID 972732
3-bromo-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-4-methylbenzamide
CID 17170937
N-(2-fluorophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide
CID 24639632
N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-4-(trifluoromethyl)benzamide
CID 24639746
N-(4-chlorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 2687824
3-bromo-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-4-propan-2-yloxybenzamide
CID 17170986
3-bromo-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-4-propoxybenzamide
CID 17170977
N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-(3-methylbutoxy)benzamide
CID 17170974

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide?
The IUPAC name of N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide (CID 2909226) is N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide?
The canonical SMILES for N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide is O=C(Nc1ccc(Br)cc1)c1cccc(S(=O)(=O)NCc2ccco2)c1.
What is the InChIKey of N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide?
The InChIKey is UFFCRSXQFDXNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrN2O4S/c19-14-6-8-15(9-7-14)21-18(22)13-3-1-5-17(11-13)26(23,24)20-12-16-4-2-10-25-16/h1-11,20H,12H2,(H,21,22).
What are the key properties of N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide?
N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide has a molecular weight of 435.30 g/mol, XLogP of 3.77, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 2909226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).