N-(2-bromophenyl)-2-chlorobenzenesulfonamide

C12H9BrClNO2S — CID 4816661

IUPACN-(2-bromophenyl)-2-chlorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1Br)c1ccccc1Cl
InChIInChI=1S/C12H9BrClNO2S/c13-9-5-1-3-7-11(9)15-18(16,17)12-8-4-2-6-10(12)14/h1-8,15H
InChIKeyMNMKCYIFKSDHDY-UHFFFAOYSA-N
MW346.63 g/mol
LogP3.90
Rot. Bonds3

About N-(2-bromophenyl)-2-chlorobenzenesulfonamide

N-(2-bromophenyl)-2-chlorobenzenesulfonamide (PubChem CID 4816661) has the molecular formula C12H9BrClNO2S and a molecular weight of 346.63 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-chlorobenzenesulfonamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2-chlorobenzenesulfonamide
PubChem CID4816661
Molecular FormulaC12H9BrClNO2S
Molecular Weight346.63 g/mol
Exact Mass344.92
IUPAC NameN-(2-bromophenyl)-2-chlorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1Br)c1ccccc1Cl
InChIInChI=1S/C12H9BrClNO2S/c13-9-5-1-3-7-11(9)15-18(16,17)12-8-4-2-6-10(12)14/h1-8,15H
InChIKeyMNMKCYIFKSDHDY-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-(2-bromophenyl)-2-methoxybenzenesulfonamide
CID 47104314
2-chloro-N-(2-hydroxy-3-methylphenyl)benzenesulfonamide
CID 79601343
N-(2-amino-5-methylphenyl)-2-chlorobenzenesulfonamide
CID 112557510
4-bromo-N-(2-bromophenyl)-2-fluorobenzenesulfonamide
CID 97455644
N-(2-bromophenyl)-2,3,4-trimethylbenzenesulfonamide
CID 21210098
N-(2-bromophenyl)-3-chloro-4-methylbenzenesulfonamide
CID 47308881
3-(aminomethyl)-N-(2-bromophenyl)-2,5-dichlorobenzenesulfonamide
CID 106061184
2-chloro-N-(2-propoxyphenyl)benzenesulfonamide
CID 7938551
3-(aminomethyl)-N-(2-bromophenyl)-2-methylbenzenesulfonamide
CID 106061237
N-(2-bromo-5-chlorophenyl)-2-(ethylamino)benzenesulfonamide
CID 81256088
2,4-dichloro-N-[2-[(2,4-dichlorophenyl)sulfonylamino]phenyl]benzenesulfonamide
CID 70137943
2,4-dibromo-N-(2,3-dichlorophenyl)benzenesulfonamide
CID 60823150

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2-chlorobenzenesulfonamide?
The IUPAC name of N-(2-bromophenyl)-2-chlorobenzenesulfonamide (CID 4816661) is N-(2-bromophenyl)-2-chlorobenzenesulfonamide.
What is the SMILES notation for N-(2-bromophenyl)-2-chlorobenzenesulfonamide?
The canonical SMILES for N-(2-bromophenyl)-2-chlorobenzenesulfonamide is O=S(=O)(Nc1ccccc1Br)c1ccccc1Cl.
What is the InChIKey of N-(2-bromophenyl)-2-chlorobenzenesulfonamide?
The InChIKey is MNMKCYIFKSDHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrClNO2S/c13-9-5-1-3-7-11(9)15-18(16,17)12-8-4-2-6-10(12)14/h1-8,15H.
What are the key properties of N-(2-bromophenyl)-2-chlorobenzenesulfonamide?
N-(2-bromophenyl)-2-chlorobenzenesulfonamide 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-(2-bromophenyl)-2-chlorobenzenesulfonamide is sourced from PubChem (CID 4816661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).