Hydroxypioglitazone

The CAS register number of Hydroxypioglitazone is 146062-44-4. It also can be called as 2,4-Thiazolidinedione,5-[[4-[2-[5-(1-hydroxyethyl)-2-pyridinyl]ethoxy]phenyl]methyl]- and the systematic name about this chemical is 5-(4-{2-[5-(1-hydroxyethyl)pyridin-2-yl]ethoxy}benzyl)-1,3-thiazolidine-2,4-dione. It belongs to the following product categories, such as Various Metabolites and Impurities, Intermediates & Fine Chemicals, Metabolites & Impurities, Pharmaceuticals and so on. This chemical can be used as a metabolite of Pioglitazone.

Physical properties about Hydroxypioglitazone are: (1)ACD/LogP: 1.11; (2)ACD/LogD (pH 5.5): 0.96; (3)ACD/LogD (pH 7.4): 0.07; (4)ACD/BCF (pH 5.5): 2.88; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 66.87; (7)ACD/KOC (pH 7.4): 8.66; (8)#H bond acceptors: 6; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 8; (11)Polar Surface Area: 94.03Ų; (12)Index of Refraction: 1.628; (13)Molar Refractivity: 99.75 cm³; (14)Molar Volume: 281 cm³; (15)Polarizability: 39.54x10^-24cm³; (16)Surface Tension: 60.8 dyne/cm; (17)Enthalpy of Vaporization: 97.63 kJ/mol; (18)Boiling Point: 627.6 °C at 760 mmHg; (19)Vapour Pressure: 1.28E-16 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC(=O)SC1Cc3ccc(OCCc2ncc(cc2)C(O)C)cc3
(2)InChI: InChI=1/C19H20N2O4S/c1-12(22)14-4-5-15(20-11-14)8-9-25-16-6-2-13(3-7-16)10-17-18(23)21-19(24)26-17/h2-7,11-12,17,22H,8-10H2,1H3,(H,21,23,24)
 (3)InChIKey: OXVFDZYQLGRLCD-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C19H20N2O4S/c1-12(22)14-4-5-15(20-11-14)8-9-25-16-6-2-13(3-7-16)10-17-18(23)21-19(24)26-17/h2-7,11-12,17,22H,8-10H2,1H3,(H,21,23,24)
(5)Std. InChIKey: OXVFDZYQLGRLCD-UHFFFAOYSA-N