2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide

C18H14Cl2N2O4S — CID 25036124

IUPAC2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cc(S(=O)(=O)NCc2ccco2)ccc1Cl
InChIInChI=1S/C18H14Cl2N2O4S/c19-12-3-5-13(6-4-12)22-18(23)16-10-15(7-8-17(16)20)27(24,25)21-11-14-2-1-9-26-14/h1-10,21H,11H2,(H,22,23)
InChIKeyVSXSGMJSTDJLMO-UHFFFAOYSA-N
MW425.29 g/mol
LogP4.32
Rot. Bonds6

About 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide

2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide (PubChem CID 25036124) has the molecular formula C18H14Cl2N2O4S and a molecular weight of 425.29 g/mol. Its IUPAC name is 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide
PubChem CID25036124
Molecular FormulaC18H14Cl2N2O4S
Molecular Weight425.29 g/mol
Exact Mass424.01
IUPAC Name2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cc(S(=O)(=O)NCc2ccco2)ccc1Cl
InChIInChI=1S/C18H14Cl2N2O4S/c19-12-3-5-13(6-4-12)22-18(23)16-10-15(7-8-17(16)20)27(24,25)21-11-14-2-1-9-26-14/h1-10,21H,11H2,(H,22,23)
InChIKeyVSXSGMJSTDJLMO-UHFFFAOYSA-N
XLogP4.32
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.29
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide?
The IUPAC name of 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide (CID 25036124) is 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide?
The canonical SMILES for 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide is O=C(Nc1ccc(Cl)cc1)c1cc(S(=O)(=O)NCc2ccco2)ccc1Cl.
What is the InChIKey of 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide?
The InChIKey is VSXSGMJSTDJLMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N2O4S/c19-12-3-5-13(6-4-12)22-18(23)16-10-15(7-8-17(16)20)27(24,25)21-11-14-2-1-9-26-14/h1-10,21H,11H2,(H,22,23).
What are the key properties of 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide?
2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide has a molecular weight of 425.29 g/mol, XLogP of 4.32, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-chlorophenyl)-5-(furan-2-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 25036124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).