2-(3,4-Dihydro-3-Oxo-2h-Benzo[B][1,4]Thiazin-2-Yl)-N-Hydroxyacetamide

Status : experimental

Chemical Classification

This compound belongs to the class of organic compounds known as benzothiazines. These are organic compounds containing a benzene fused to a thiazine ring (a six-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).

Benzothiazines

Organic compounds

Organoheterocyclic compounds

Benzothiazines

Calculated Property

kind Value Source
logP 0.53 ALOGPS
logS -2.6 ALOGPS
Water Solubility 6.23e-01 g/l ALOGPS
logP 0.35 ChemAxon
IUPAC Name N-hydroxy-2-[(2R)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl]acetamide ChemAxon
Traditional IUPAC Name N-hydroxy-2-[(2R)-3-oxo-2,4-dihydro-1,4-benzothiazin-2-yl]acetamide ChemAxon
Molecular Weight 238.263 ChemAxon
Monoisotopic Weight 238.041212886 ChemAxon
SMILES [H][C@]1(CC(=O)NO)SC2=CC=CC=C2NC1=O ChemAxon
Molecular Formula C10H10N2O3S ChemAxon
InChI InChI=1S/C10H10N2O3S/c13-9(12-15)5-8-10(14)11-6-3-1-2-4-7(6)16-8/h1-4,8,15H,5H2,(H,11,14)(H,12,13)/t8-/m1/s1 ChemAxon
InChIKey InChIKey=UKDWCJNGBPZOBU-MRVPVSSYSA-N ChemAxon
Polar Surface Area (PSA) 78.43 ChemAxon
Refractivity 61.38 ChemAxon
Polarizability 22.66 ChemAxon
Rotatable Bond Count 2 ChemAxon
H Bond Acceptor Count 3 ChemAxon
H Bond Donor Count 3 ChemAxon
pKa (strongest acidic) 8.89 ChemAxon
pKa (strongest basic) -5.5 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

  • Peptide deformylase : in Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 / 1C / PRS 101 / LMG 12228)