3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide

C14H11Cl2F2NO2S — CID 164624508

IUPAC3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide
SMILESCCN(c1ccc(F)cc1F)S(=O)(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl2F2NO2S/c1-2-19(14-4-3-11(17)8-13(14)18)22(20,21)12-6-9(15)5-10(16)7-12/h3-8H,2H2,1H3
InChIKeyJIKKAHIKBJIIFH-UHFFFAOYSA-N
MW366.22 g/mol
LogP4.49
Rot. Bonds4

About 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide

3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide (PubChem CID 164624508) has the molecular formula C14H11Cl2F2NO2S and a molecular weight of 366.22 g/mol. Its IUPAC name is 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide.

Molecular Properties

Compound Name3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide
PubChem CID164624508
Molecular FormulaC14H11Cl2F2NO2S
Molecular Weight366.22 g/mol
Exact Mass364.99
IUPAC Name3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide
SMILESCCN(c1ccc(F)cc1F)S(=O)(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl2F2NO2S/c1-2-19(14-4-3-11(17)8-13(14)18)22(20,21)12-6-9(15)5-10(16)7-12/h3-8H,2H2,1H3
InChIKeyJIKKAHIKBJIIFH-UHFFFAOYSA-N
XLogP4.49
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.22
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide?
The IUPAC name of 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide (CID 164624508) is 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide.
What is the SMILES notation for 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide?
The canonical SMILES for 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide is CCN(c1ccc(F)cc1F)S(=O)(=O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide?
The InChIKey is JIKKAHIKBJIIFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2F2NO2S/c1-2-19(14-4-3-11(17)8-13(14)18)22(20,21)12-6-9(15)5-10(16)7-12/h3-8H,2H2,1H3.
What are the key properties of 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide?
3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide has a molecular weight of 366.22 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(2,4-difluorophenyl)-N-ethylbenzenesulfonamide is sourced from PubChem (CID 164624508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).