N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide

C12H7BrClF2NO2S — CID 103480186

IUPACN-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1cccc(Cl)c1Br)c1ccc(F)cc1F
InChIInChI=1S/C12H7BrClF2NO2S/c13-12-8(14)2-1-3-10(12)17-20(18,19)11-5-4-7(15)6-9(11)16/h1-6,17H
InChIKeyJHNTXQONJSJZPU-UHFFFAOYSA-N
MW382.61 g/mol
LogP4.18
Rot. Bonds3

About N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide

N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide (PubChem CID 103480186) has the molecular formula C12H7BrClF2NO2S and a molecular weight of 382.61 g/mol. Its IUPAC name is N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide.

Molecular Properties

Compound NameN-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide
PubChem CID103480186
Molecular FormulaC12H7BrClF2NO2S
Molecular Weight382.61 g/mol
Exact Mass380.90
IUPAC NameN-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1cccc(Cl)c1Br)c1ccc(F)cc1F
InChIInChI=1S/C12H7BrClF2NO2S/c13-12-8(14)2-1-3-10(12)17-20(18,19)11-5-4-7(15)6-9(11)16/h1-6,17H
InChIKeyJHNTXQONJSJZPU-UHFFFAOYSA-N
XLogP4.18
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.61
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-(2-bromo-3-chlorophenyl)-2-fluorobenzenesulfonamide
CID 103480213
2-bromo-N-(2-bromo-3-chlorophenyl)-4,6-difluorobenzenesulfonamide
CID 103481212
N-(2-bromo-4-fluorophenyl)-2,4-difluorobenzenesulfonamide
CID 43328562
2-amino-4-bromo-N-(2-bromo-3-chlorophenyl)benzenesulfonamide
CID 103477338
5-amino-N-(2-bromo-3-chlorophenyl)-3-chloro-2-fluorobenzenesulfonamide
CID 103477337
N-(2,4-difluorophenyl)-2,4-difluorobenzenesulfonamide
CID 3312178
4-chloro-N-(2,4-difluorophenyl)-2-fluorobenzenesulfonamide
CID 4968602
N-(4-bromo-2-fluorophenyl)-2,4-difluorobenzenesulfonamide
CID 8500760
2-bromo-3-chloro-N-(2,3-difluorophenyl)benzenesulfonamide
CID 154840283
N-(2-chlorophenyl)-2,5-difluorobenzenesulfonamide
CID 9234601
4-bromo-N-(2,5-difluorophenyl)-2-fluorobenzenesulfonamide
CID 97455684
N-(2-chlorophenyl)-4-fluoro-2-methylbenzenesulfonamide
CID 47148910

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide?
The IUPAC name of N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide (CID 103480186) is N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide.
What is the SMILES notation for N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide?
The canonical SMILES for N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide is O=S(=O)(Nc1cccc(Cl)c1Br)c1ccc(F)cc1F.
What is the InChIKey of N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide?
The InChIKey is JHNTXQONJSJZPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7BrClF2NO2S/c13-12-8(14)2-1-3-10(12)17-20(18,19)11-5-4-7(15)6-9(11)16/h1-6,17H.
What are the key properties of N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide?
N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide has a molecular weight of 382.61 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-3-chlorophenyl)-2,4-difluorobenzenesulfonamide is sourced from PubChem (CID 103480186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).