2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide

C20H15Cl3N2O3S — CID 126320810

IUPAC2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide
SMILESO=C(CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C20H15Cl3N2O3S/c21-14-6-9-17(10-7-14)29(27,28)25(16-4-2-1-3-5-16)13-20(26)24-19-12-15(22)8-11-18(19)23/h1-12H,13H2,(H,24,26)
InChIKeyGRHJVYLLFIUHEA-UHFFFAOYSA-N
MW469.78 g/mol
LogP5.48
Rot. Bonds6

About 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide

2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide (PubChem CID 126320810) has the molecular formula C20H15Cl3N2O3S and a molecular weight of 469.78 g/mol. Its IUPAC name is 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide
PubChem CID126320810
Molecular FormulaC20H15Cl3N2O3S
Molecular Weight469.78 g/mol
Exact Mass467.99
IUPAC Name2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide
SMILESO=C(CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C20H15Cl3N2O3S/c21-14-6-9-17(10-7-14)29(27,28)25(16-4-2-1-3-5-16)13-20(26)24-19-12-15(22)8-11-18(19)23/h1-12H,13H2,(H,24,26)
InChIKeyGRHJVYLLFIUHEA-UHFFFAOYSA-N
XLogP5.48
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.78
LogP ≤ 55.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide?
The IUPAC name of 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide (CID 126320810) is 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide is O=C(CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide?
The InChIKey is GRHJVYLLFIUHEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl3N2O3S/c21-14-6-9-17(10-7-14)29(27,28)25(16-4-2-1-3-5-16)13-20(26)24-19-12-15(22)8-11-18(19)23/h1-12H,13H2,(H,24,26).
What are the key properties of 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide?
2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide has a molecular weight of 469.78 g/mol, XLogP of 5.48, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-(4-chlorophenyl)sulfonylanilino)-N-(2,5-dichlorophenyl)acetamide is sourced from PubChem (CID 126320810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).