N-(5-bromo-2-chlorophenyl)benzenesulfonamide

C12H9BrClNO2S — CID 62909796

IUPACN-(5-bromo-2-chlorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(Br)ccc1Cl)c1ccccc1
InChIInChI=1S/C12H9BrClNO2S/c13-9-6-7-11(14)12(8-9)15-18(16,17)10-4-2-1-3-5-10/h1-8,15H
InChIKeyGVFZUMLTCDYETO-UHFFFAOYSA-N
MW346.63 g/mol
LogP3.90
Rot. Bonds3

About N-(5-bromo-2-chlorophenyl)benzenesulfonamide

N-(5-bromo-2-chlorophenyl)benzenesulfonamide (PubChem CID 62909796) has the molecular formula C12H9BrClNO2S and a molecular weight of 346.63 g/mol. Its IUPAC name is N-(5-bromo-2-chlorophenyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(5-bromo-2-chlorophenyl)benzenesulfonamide
PubChem CID62909796
Molecular FormulaC12H9BrClNO2S
Molecular Weight346.63 g/mol
Exact Mass344.92
IUPAC NameN-(5-bromo-2-chlorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(Br)ccc1Cl)c1ccccc1
InChIInChI=1S/C12H9BrClNO2S/c13-9-6-7-11(14)12(8-9)15-18(16,17)10-4-2-1-3-5-10/h1-8,15H
InChIKeyGVFZUMLTCDYETO-UHFFFAOYSA-N
XLogP3.90
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.63
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-2-chlorophenyl)-4-nitrobenzenesulfonamide
CID 62907756
4-bromo-N-(5-bromo-2-chlorophenyl)-2,6-dichlorobenzenesulfonamide
CID 63421665
N-(5-amino-2-chlorophenyl)-3-bromobenzenesulfonamide
CID 43550719
N-(5-bromo-2-chlorophenyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 62908088
N-(2-bromo-5-chloro-4-methylphenyl)benzenesulfonamide
CID 113443382
N-(5-bromo-2-chlorophenyl)thiophene-2-sulfonamide
CID 55132063
3-(benzenesulfonamido)-4-chloro-N-(3,5-dimethylphenyl)benzamide
CID 1020081
N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-sulfonamide
CID 64601121
N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide
CID 110362791
5-(aminomethyl)-N-(5-bromo-2-chlorophenyl)furan-2-sulfonamide
CID 106056693
N-(2-amino-4-bromophenyl)-3,4-dichlorobenzenesulfonamide
CID 43344070
N-(5-bromo-2-methylphenyl)-4-phenylbenzenesulfonamide
CID 4677884

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-chlorophenyl)benzenesulfonamide?
The IUPAC name of N-(5-bromo-2-chlorophenyl)benzenesulfonamide (CID 62909796) is N-(5-bromo-2-chlorophenyl)benzenesulfonamide.
What is the SMILES notation for N-(5-bromo-2-chlorophenyl)benzenesulfonamide?
The canonical SMILES for N-(5-bromo-2-chlorophenyl)benzenesulfonamide is O=S(=O)(Nc1cc(Br)ccc1Cl)c1ccccc1.
What is the InChIKey of N-(5-bromo-2-chlorophenyl)benzenesulfonamide?
The InChIKey is GVFZUMLTCDYETO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrClNO2S/c13-9-6-7-11(14)12(8-9)15-18(16,17)10-4-2-1-3-5-10/h1-8,15H.
What are the key properties of N-(5-bromo-2-chlorophenyl)benzenesulfonamide?
N-(5-bromo-2-chlorophenyl)benzenesulfonamide has a molecular weight of 346.63 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-chlorophenyl)benzenesulfonamide is sourced from PubChem (CID 62909796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).