2,5-dichloro-4-methylbenzenesulfonamide

C7H7Cl2NO2S — CID 104727916

IUPAC2,5-dichloro-4-methylbenzenesulfonamide
SMILESCc1cc(Cl)c(S(N)(=O)=O)cc1Cl
InChIInChI=1S/C7H7Cl2NO2S/c1-4-2-6(9)7(3-5(4)8)13(10,11)12/h2-3H,1H3,(H2,10,11,12)
InChIKeyVRTZTDLUGCPZBU-UHFFFAOYSA-N
MW240.11 g/mol
LogP1.95
Rot. Bonds1

About 2,5-dichloro-4-methylbenzenesulfonamide

2,5-dichloro-4-methylbenzenesulfonamide (PubChem CID 104727916) has the molecular formula C7H7Cl2NO2S and a molecular weight of 240.11 g/mol. Its IUPAC name is 2,5-dichloro-4-methylbenzenesulfonamide.

Molecular Properties

Compound Name2,5-dichloro-4-methylbenzenesulfonamide
PubChem CID104727916
Molecular FormulaC7H7Cl2NO2S
Molecular Weight240.11 g/mol
Exact Mass238.96
IUPAC Name2,5-dichloro-4-methylbenzenesulfonamide
SMILESCc1cc(Cl)c(S(N)(=O)=O)cc1Cl
InChIInChI=1S/C7H7Cl2NO2S/c1-4-2-6(9)7(3-5(4)8)13(10,11)12/h2-3H,1H3,(H2,10,11,12)
InChIKeyVRTZTDLUGCPZBU-UHFFFAOYSA-N
XLogP1.95
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.11
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,5-dichloro-4-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-chloro-2-fluoro-5-methylbenzenesulfonamide
CID 71106537
1-chloro-4-(4-chloro-2,5-dimethylphenyl)sulfonyl-2,5-dimethylbenzene
CID 19736981
4-chloro-2,5-dimethylbenzenesulfonic acid
CID 14910662
4-chloro-2,5-dimethylbenzenesulfonohydrazide
CID 2799465
1-chloro-4,5-dimethyl-2-methylsulfonylbenzene
CID 22101507
5-chloro-4-ethoxy-2-methylbenzenesulfonamide
CID 82297288
N-(4,5-dichloro-2-sulfamoylphenyl)acetamide
CID 154352075
2,4,5-trimethylbenzenesulfonamide
CID 961422
6-chloro-2,3-dihydro-1H-isoindole-5-sulfonamide
CID 54262102
5-amino-3-chloro-2-methylbenzenesulfonamide
CID 68873212
4-chloro-5-methylbenzene-1,3-disulfonamide
CID 134098209
5-chloro-2,4-di(propan-2-yl)benzenesulfonamide
CID 21491933

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-4-methylbenzenesulfonamide?
The IUPAC name of 2,5-dichloro-4-methylbenzenesulfonamide (CID 104727916) is 2,5-dichloro-4-methylbenzenesulfonamide.
What is the SMILES notation for 2,5-dichloro-4-methylbenzenesulfonamide?
The canonical SMILES for 2,5-dichloro-4-methylbenzenesulfonamide is Cc1cc(Cl)c(S(N)(=O)=O)cc1Cl.
What is the InChIKey of 2,5-dichloro-4-methylbenzenesulfonamide?
The InChIKey is VRTZTDLUGCPZBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7Cl2NO2S/c1-4-2-6(9)7(3-5(4)8)13(10,11)12/h2-3H,1H3,(H2,10,11,12).
What are the key properties of 2,5-dichloro-4-methylbenzenesulfonamide?
2,5-dichloro-4-methylbenzenesulfonamide has a molecular weight of 240.11 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-4-methylbenzenesulfonamide is sourced from PubChem (CID 104727916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).