N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide

C12H8BrF2NO2S — CID 2648231

IUPACN-(2-bromophenyl)-2,6-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1Br)c1c(F)cccc1F
InChIInChI=1S/C12H8BrF2NO2S/c13-8-4-1-2-7-11(8)16-19(17,18)12-9(14)5-3-6-10(12)15/h1-7,16H
InChIKeyDRBCQWHDYIIIFI-UHFFFAOYSA-N
MW348.17 g/mol
LogP3.53
Rot. Bonds3

About N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide

N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide (PubChem CID 2648231) has the molecular formula C12H8BrF2NO2S and a molecular weight of 348.17 g/mol. Its IUPAC name is N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2,6-difluorobenzenesulfonamide
PubChem CID2648231
Molecular FormulaC12H8BrF2NO2S
Molecular Weight348.17 g/mol
Exact Mass346.94
IUPAC NameN-(2-bromophenyl)-2,6-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1Br)c1c(F)cccc1F
InChIInChI=1S/C12H8BrF2NO2S/c13-8-4-1-2-7-11(8)16-19(17,18)12-9(14)5-3-6-10(12)15/h1-7,16H
InChIKeyDRBCQWHDYIIIFI-UHFFFAOYSA-N
XLogP3.53
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.17
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide 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

N-(2-bromophenyl)-4-fluorobenzenesulfonamide
CID 835592
4-bromo-N-(2-bromophenyl)-2-fluorobenzenesulfonamide
CID 97455644
2,6-difluoro-N-[2-(methylaminomethyl)phenyl]benzenesulfonamide
CID 43606132
2,3,4,5,6-pentafluoro-N-(2-fluorophenyl)benzenesulfonamide
CID 134093089
5-amino-N-(2-bromophenyl)-2,3-difluorobenzenesulfonamide
CID 65023507
3-[(2,6-difluorophenyl)sulfonylamino]-2-fluorobenzoic acid
CID 71269303
2-[(2-bromophenyl)sulfonylamino]-6-fluorobenzoic acid
CID 43443122
2,6-difluoro-N-(2-pyrazol-1-ylphenyl)benzenesulfonamide
CID 60532169
N-(2-fluorophenyl)-2,3,4,5,6-pentamethylbenzenesulfonamide
CID 22773407
N-(2-bromophenyl)-2,6-dimethyl-4-(methylamino)benzenesulfonamide
CID 107328567
N-(2-bromophenyl)-3-cyano-4-fluorobenzenesulfonamide
CID 63236123
5-amino-2-bromo-N-(2-fluorophenyl)benzenesulfonamide
CID 65201946

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide?
The IUPAC name of N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide (CID 2648231) is N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide.
What is the SMILES notation for N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide?
The canonical SMILES for N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide is O=S(=O)(Nc1ccccc1Br)c1c(F)cccc1F.
What is the InChIKey of N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide?
The InChIKey is DRBCQWHDYIIIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrF2NO2S/c13-8-4-1-2-7-11(8)16-19(17,18)12-9(14)5-3-6-10(12)15/h1-7,16H.
What are the key properties of N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide?
N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide has a molecular weight of 348.17 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2,6-difluorobenzenesulfonamide is sourced from PubChem (CID 2648231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).