10967/147 - QDB Compounds

QsarDB Repository

Thakur, A. QSAR study on benzenesulfonamide ionization constant: physicochemical approach using surface tension. ARKIVOC 2005, 2005, 49-58.

Compound

ID:12
Name:4-amino-N-(3-chlorophenyl)benzene-1-sulfonamide
Description:Names and InChI codes were generated with JChem for Excel
Labels:
CAS:
InChi Code:InChI=1S/C12H11ClN2O2S/c13-9-2-1-3-11(8-9)15-18(16,17)12-6-4-10(14)5-7-12/h1-8,15H,14H2

Properties

pKa: Acid dissociation constant as log(1/Ka)

ValueSource or prediction
8.28

experimental value

8.26

Eq9: Model for benzenesulfonamides (Training set)

Links to External Resources