2-bromo-3-chloro-6-methylbenzenesulfonamide

C7H7BrClNO2S — CID 131538705

IUPAC2-bromo-3-chloro-6-methylbenzenesulfonamide
SMILESCc1ccc(Cl)c(Br)c1S(N)(=O)=O
InChIInChI=1S/C7H7BrClNO2S/c1-4-2-3-5(9)6(8)7(4)13(10,11)12/h2-3H,1H3,(H2,10,11,12)
InChIKeyJBWQEIGMZAYUBT-UHFFFAOYSA-N
MW284.56 g/mol
LogP2.06
Rot. Bonds1

About 2-bromo-3-chloro-6-methylbenzenesulfonamide

2-bromo-3-chloro-6-methylbenzenesulfonamide (PubChem CID 131538705) has the molecular formula C7H7BrClNO2S and a molecular weight of 284.56 g/mol. Its IUPAC name is 2-bromo-3-chloro-6-methylbenzenesulfonamide.

Molecular Properties

Compound Name2-bromo-3-chloro-6-methylbenzenesulfonamide
PubChem CID131538705
Molecular FormulaC7H7BrClNO2S
Molecular Weight284.56 g/mol
Exact Mass282.91
IUPAC Name2-bromo-3-chloro-6-methylbenzenesulfonamide
SMILESCc1ccc(Cl)c(Br)c1S(N)(=O)=O
InChIInChI=1S/C7H7BrClNO2S/c1-4-2-3-5(9)6(8)7(4)13(10,11)12/h2-3H,1H3,(H2,10,11,12)
InChIKeyJBWQEIGMZAYUBT-UHFFFAOYSA-N
XLogP2.06
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.56
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-bromo-3-chloro-6-methylbenzenesulfonamide 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

4-Bromo-5-chloro-2-methylbenzene-1-sulfonyl fluoride
CID 165790746
4-Bromo-5-chloro-2-methylbenzenesulfonyl chloride
CID 50998048
4-Bromo-3-chloro-2-methylbenzenesulfonamide
CID 50998107
2-Bromo-6-(chloromethyl)benzenesulfonamide
CID 153638882
2-Bromo-3-chloro-4-methylbenzenesulfonyl iodide
CID 154173490
2-Bromo-5-chloro-4-methylbenzenesulfonamide
CID 50876692
3-Bromo-5-chloro-2-methylbenzene sulfonamide
CID 50998108
2-Bromo-4-chloro-6-methylbenzenesulfonamide
CID 50998110
3-Bromo-5-chloro-2-methylbenzenesulfonamide
CID 53443946
(3-Bromo-4-chlorophenyl)methanesulfonamide
CID 83231153
2-Bromo-3-chloro-6-methylbenzenethiol
CID 91874661
2-Bromo-3-chloro-6-cyanobenzene-1-sulfonyl chloride
CID 130839428

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-chloro-6-methylbenzenesulfonamide?
The IUPAC name of 2-bromo-3-chloro-6-methylbenzenesulfonamide (CID 131538705) is 2-bromo-3-chloro-6-methylbenzenesulfonamide.
What is the SMILES notation for 2-bromo-3-chloro-6-methylbenzenesulfonamide?
The canonical SMILES for 2-bromo-3-chloro-6-methylbenzenesulfonamide is Cc1ccc(Cl)c(Br)c1S(N)(=O)=O.
What is the InChIKey of 2-bromo-3-chloro-6-methylbenzenesulfonamide?
The InChIKey is JBWQEIGMZAYUBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrClNO2S/c1-4-2-3-5(9)6(8)7(4)13(10,11)12/h2-3H,1H3,(H2,10,11,12).
What are the key properties of 2-bromo-3-chloro-6-methylbenzenesulfonamide?
2-bromo-3-chloro-6-methylbenzenesulfonamide has a molecular weight of 284.56 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-3-chloro-6-methylbenzenesulfonamide is sourced from PubChem (CID 131538705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).