2-((4′-HYDROXYNAPHTHYL)-AZO)BENZOIC ACID

Status : experimental

Chemical Classification

This compound belongs to the class of organic compounds known as azobenzenes. These are organonitrogen aromatic compounds that contain a central azo group, where each nitrogen atom is conjugated to a bezene ring.

Azobenzenes

Organic compounds

Organoheterocyclic compounds

Azobenzenes

Calculated Property

kind Value Source
logP 4.69 ALOGPS
logS -4.4 ALOGPS
Water Solubility 1.25e-02 g/l ALOGPS
logP 4.72 ChemAxon
IUPAC Name 2-[(E)-2-(4-hydroxynaphthalen-1-yl)diazen-1-yl]benzoic acid ChemAxon
Traditional IUPAC Name 2-[(E)-2-(4-hydroxynaphthalen-1-yl)diazen-1-yl]benzoic acid ChemAxon
Molecular Weight 292.2888 ChemAxon
Monoisotopic Weight 292.08479226 ChemAxon
SMILES OC(=O)C1=CC=CC=C1N=NC1=C2C=CC=CC2=C(O)C=C1 ChemAxon
Molecular Formula C17H12N2O3 ChemAxon
InChI InChI=1S/C17H12N2O3/c20-16-10-9-15(11-5-1-2-6-12(11)16)19-18-14-8-4-3-7-13(14)17(21)22/h1-10,20H,(H,21,22)/b19-18+ ChemAxon
InChIKey InChIKey=SXAUIPSOPPASFY-VHEBQXMUSA-N ChemAxon
Polar Surface Area (PSA) 82.25 ChemAxon
Refractivity 86.06 ChemAxon
Polarizability 30.21 ChemAxon
Rotatable Bond Count 3 ChemAxon
H Bond Acceptor Count 5 ChemAxon
H Bond Donor Count 2 ChemAxon
pKa (strongest acidic) 3.36 ChemAxon
pKa (strongest basic) -0.18 ChemAxon
Physiological Charge -1 ChemAxon
Number of Rings 3 ChemAxon
Bioavailability 1 ChemAxon
Rule of Five 1 ChemAxon
Ghose Filter 1 ChemAxon
MDDR-Like Rule 0 ChemAxon

Target within organism

  • Streptavidin : in Streptomyces avidinii