2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide

C20H14Cl2F2N2O3S — CID 126331811

IUPAC2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide
SMILESO=C(CN(c1ccc(Cl)cc1Cl)S(=O)(=O)c1ccccc1)Nc1c(F)cccc1F
InChIInChI=1S/C20H14Cl2F2N2O3S/c21-13-9-10-18(15(22)11-13)26(30(28,29)14-5-2-1-3-6-14)12-19(27)25-20-16(23)7-4-8-17(20)24/h1-11H,12H2,(H,25,27)
InChIKeyZKHRJIDPDHDKMD-UHFFFAOYSA-N
MW471.31 g/mol
LogP5.11
Rot. Bonds6

About 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide

2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide (PubChem CID 126331811) has the molecular formula C20H14Cl2F2N2O3S and a molecular weight of 471.31 g/mol. Its IUPAC name is 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide
PubChem CID126331811
Molecular FormulaC20H14Cl2F2N2O3S
Molecular Weight471.31 g/mol
Exact Mass470.01
IUPAC Name2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide
SMILESO=C(CN(c1ccc(Cl)cc1Cl)S(=O)(=O)c1ccccc1)Nc1c(F)cccc1F
InChIInChI=1S/C20H14Cl2F2N2O3S/c21-13-9-10-18(15(22)11-13)26(30(28,29)14-5-2-1-3-6-14)12-19(27)25-20-16(23)7-4-8-17(20)24/h1-11H,12H2,(H,25,27)
InChIKeyZKHRJIDPDHDKMD-UHFFFAOYSA-N
XLogP5.11
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.31
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[N-(benzenesulfonyl)-2-chloro-5-(trifluoromethyl)anilino]-N-(2,6-difluorophenyl)acetamide
CID 2207937
2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 1299985
2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 100500876
2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(4-bromo-3-methylphenyl)acetamide
CID 51344789
2-(N-(4-chlorophenyl)sulfonyl-3-methylanilino)-N-(2,6-difluorophenyl)acetamide
CID 3284151
2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-[(2R)-pentan-2-yl]acetamide
CID 126275595
2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-[3-(4-fluorophenyl)propyl]acetamide
CID 30209855
2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(3-methylbutyl)acetamide
CID 126270307
2-[N-(benzenesulfonyl)-2-fluoroanilino]-N-(2,6-diethylphenyl)acetamide
CID 126120612
2-[N-(benzenesulfonyl)-2,3-dichloroanilino]-N-(2-fluorophenyl)acetamide
CID 2282100
N-(2,6-difluorophenyl)-2-(N-(4-fluorophenyl)sulfonylanilino)acetamide
CID 2223913
2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-[4-[(3-chloro-2-methylphenyl)sulfamoyl]phenyl]acetamide
CID 43880667

Frequently Asked Questions

What is the IUPAC name of 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide?
The IUPAC name of 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide (CID 126331811) is 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide.
What is the SMILES notation for 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide?
The canonical SMILES for 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide is O=C(CN(c1ccc(Cl)cc1Cl)S(=O)(=O)c1ccccc1)Nc1c(F)cccc1F.
What is the InChIKey of 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide?
The InChIKey is ZKHRJIDPDHDKMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14Cl2F2N2O3S/c21-13-9-10-18(15(22)11-13)26(30(28,29)14-5-2-1-3-6-14)12-19(27)25-20-16(23)7-4-8-17(20)24/h1-11H,12H2,(H,25,27).
What are the key properties of 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide?
2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide has a molecular weight of 471.31 g/mol, XLogP of 5.11, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(benzenesulfonyl)-2,4-dichloroanilino]-N-(2,6-difluorophenyl)acetamide is sourced from PubChem (CID 126331811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).