1.0 2016-05-22 03:42:16 UTC 2026-08-21 21:49:21 UTC Ketanserin SmallMolecule Ketanserin is an organic compound with the chemical formula C22H22FN3O3 and an average molecular weight of 395.43 g/mol. Ketanserin belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. In terms of biological activity, the compound is recorded as an inverse agonist of the 5-hydroxytryptamine receptor 2A (HTR2A). The compound has been identified in or released from 32 recorded sources across several diverse categories. Within electrical and electronic equipment, it is associated with antennas, coils, amplifiers, colour television systems, and conductors or conductive bodies characterised by the conductive materials, among 16 other sources. In the sector of food, food processing and cookware, it is found in the processing of meats, food preservation, the preparation of wine or sparkling wine, and fermentation processes for beer. Its presence is also noted in household cleaning and consumer products, specifically in soap detergents, perfumes within detergents and soaps, tobacco smoke filters, and non electric simulated smoking devices. Additionally, ketanserin is released from household items such as key rings and from building and construction materials, including roofs and fencing. C22H22FN3O3 395.434 395.164519743 3-{2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl}-1,2,3,4-tetrahydroquinazoline-2,4-dione ketanserin 74050-98-9 FC1=CC=C(C=C1)C(=O)C1CCN(CCN2C(=O)NC3=CC=CC=C3C2=O)CC1 InChI=1S/C22H22FN3O3/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29) FPCCSQOGAWCVBH-UHFFFAOYSA-N Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Alkyl-phenylketones Aryl alkyl ketones Aryl fluorides Azacyclic compounds Benzoyl derivatives Fluorobenzenes Gamma-amino ketones Heteroaromatic compounds Hydrocarbon derivatives Hydroxypyrimidines Lactams Organic oxides Organofluorides Organopnictogen compounds Piperidines Pyrimidones Quinazolines Trialkylamines Alkyl-phenylketone Amine Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl fluoride Aryl halide Azacycle Benzenoid Benzoyl Diazanaphthalene Fluorobenzene Gamma-aminoketone Halobenzene Heteroaromatic compound Hydrocarbon derivative Hydroxypyrimidine Lactam Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organofluoride Organohalogen compound Organoheterocyclic compound Organonitrogen compound Organopnictogen compound Piperidine Pyrimidine Pyrimidone Quinazoline Tertiary aliphatic amine Tertiary amine Aromatic heteropolycyclic compounds aromatic ketone organofluorine compound piperidines quinazolines Detected and Not Quantified logp 3.61 logp 2.92 ALOGPS logs -3.40 ALOGPS solubility 1.56e-01 g/l ALOGPS logp 3.61 ChemAxon pka_strongest_acidic 11.42 ChemAxon pka_strongest_basic 7.29 ChemAxon iupac 3-{2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl}-1,2,3,4-tetrahydroquinazoline-2,4-dione ChemAxon average_mass 395.434 ChemAxon mono_mass 395.164519743 ChemAxon smiles FC1=CC=C(C=C1)C(=O)C1CCN(CCN2C(=O)NC3=CC=CC=C3C2=O)CC1 ChemAxon formula C22H22FN3O3 ChemAxon inchi InChI=1S/C22H22FN3O3/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29) ChemAxon inchikey FPCCSQOGAWCVBH-UHFFFAOYSA-N ChemAxon polar_surface_area 69.72 ChemAxon refractivity 109.11 ChemAxon polarizability 39.89 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bb384c4e8> DB12465 3822 3690 BE0000451