N-(2-bromo-3-chlorophenyl)methanesulfonamide

C7H7BrClNO2S — CID 67639516

IUPACN-(2-bromo-3-chlorophenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1cccc(Cl)c1Br
InChIInChI=1S/C7H7BrClNO2S/c1-13(11,12)10-6-4-2-3-5(9)7(6)8/h2-4,10H,1H3
InChIKeyTWIUYMMFARQMGF-UHFFFAOYSA-N
MW284.56 g/mol
LogP2.47
Rot. Bonds2

About N-(2-bromo-3-chlorophenyl)methanesulfonamide

N-(2-bromo-3-chlorophenyl)methanesulfonamide (PubChem CID 67639516) has the molecular formula C7H7BrClNO2S and a molecular weight of 284.56 g/mol. Its IUPAC name is N-(2-bromo-3-chlorophenyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-bromo-3-chlorophenyl)methanesulfonamide
PubChem CID67639516
Molecular FormulaC7H7BrClNO2S
Molecular Weight284.56 g/mol
Exact Mass282.91
IUPAC NameN-(2-bromo-3-chlorophenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1cccc(Cl)c1Br
InChIInChI=1S/C7H7BrClNO2S/c1-13(11,12)10-6-4-2-3-5(9)7(6)8/h2-4,10H,1H3
InChIKeyTWIUYMMFARQMGF-UHFFFAOYSA-N
XLogP2.47
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.56
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-bromo-3-chlorophenyl)methanesulfonamide 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

2-Bromo-5-chloroaniline
CID 11310276
2-Bromo-3-chloroaniline
CID 11843442
N-(3-chlorophenyl)methanesulfonamide
CID 849123
4-Bromo-3-chloroaniline
CID 88888
N-(2-bromophenyl)methanesulfonamide
CID 3629878
N-(4-bromo-2-chlorophenyl)methanesulfonamide
CID 22774632
(2S)-N-(2-bromo-5-chlorophenyl)-2-methoxypropane-1-sulfonamide
CID 164634346
N-(2-bromo-5-chloro-4-fluorophenyl)methanesulfonamide
CID 68536086
N-(2-bromo-4-chloro-6-fluorophenyl)methanesulfonamide
CID 89773707
N-(2-bromo-6-chloro-4-fluorophenyl)methanesulfonamide
CID 89775133
N-(2,6-dibromo-3-chloro-4-fluorophenyl)methanesulfonamide
CID 89775137
N-(3-bromo-4-chlorophenyl)-1,1-difluoromethanesulfonamide
CID 80091106

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-3-chlorophenyl)methanesulfonamide?
The IUPAC name of N-(2-bromo-3-chlorophenyl)methanesulfonamide (CID 67639516) is N-(2-bromo-3-chlorophenyl)methanesulfonamide.
What is the SMILES notation for N-(2-bromo-3-chlorophenyl)methanesulfonamide?
The canonical SMILES for N-(2-bromo-3-chlorophenyl)methanesulfonamide is CS(=O)(=O)Nc1cccc(Cl)c1Br.
What is the InChIKey of N-(2-bromo-3-chlorophenyl)methanesulfonamide?
The InChIKey is TWIUYMMFARQMGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrClNO2S/c1-13(11,12)10-6-4-2-3-5(9)7(6)8/h2-4,10H,1H3.
What are the key properties of N-(2-bromo-3-chlorophenyl)methanesulfonamide?
N-(2-bromo-3-chlorophenyl)methanesulfonamide has a molecular weight of 284.56 g/mol, XLogP of 2.47, 2 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)methanesulfonamide is sourced from PubChem (CID 67639516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).