N-Benzyl-4-Sulfamoyl-Benzamide

Status : experimental

Chemical Classification

This compound belongs to the class of organic compounds known as n-benzylbenzamides. These are compounds containing a benzamide moiety that is N-linked to a benzyl group.

N-benzylbenzamides

Organic compounds

Benzenoids

Benzene and substituted derivatives

Benzamides

Calculated Property

kind Value Source
logP 1.27 ALOGPS
logS -3.8 ALOGPS
Water Solubility 4.51e-02 g/l ALOGPS
logP 1.38 ChemAxon
IUPAC Name N-benzyl-4-sulfamoylbenzamide ChemAxon
Traditional IUPAC Name N-benzyl-4-sulfamoyl-benzamide ChemAxon
Molecular Weight 290.338 ChemAxon
Monoisotopic Weight 290.072513014 ChemAxon
SMILES NS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC1=CC=CC=C1 ChemAxon
Molecular Formula C14H14N2O3S ChemAxon
InChI InChI=1S/C14H14N2O3S/c15-20(18,19)13-8-6-12(7-9-13)14(17)16-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,16,17)(H2,15,18,19) ChemAxon
InChIKey InChIKey=CZKNSZUJCJHTTM-UHFFFAOYSA-N ChemAxon
Polar Surface Area (PSA) 89.26 ChemAxon
Refractivity 76.8 ChemAxon
Polarizability 29.74 ChemAxon
Rotatable Bond Count 4 ChemAxon
H Bond Acceptor Count 3 ChemAxon
H Bond Donor Count 2 ChemAxon
pKa (strongest acidic) 9.95 ChemAxon
pKa (strongest basic) -1.3 ChemAxon
Physiological Charge 0 ChemAxon
Number of Rings 2 ChemAxon
Bioavailability 1 ChemAxon
Rule of Five 1 ChemAxon
Ghose Filter 1 ChemAxon
MDDR-Like Rule 0 ChemAxon

Target within organism

  • Carbonic anhydrase 2 : in Human