1.0 2026-09-22 09:06:38 UTC 2026-09-22 09:06:38 UTC FDB118014 Flavopiridol 2-(2-chlorophenyl)-5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methyl-4-piperidyl]chromen-4-one 2-(2-chlorophenyl)-5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]chromen-4-one C21H20ClNO5 401.84 401.103000462 2-(2-chlorophenyl)-5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]-4H-chromen-4-one flavopiridol CN1CC[C@@H]([C@H](O)C1)C1=C(O)C=C(O)C2=C1OC(=CC2=O)C1=CC=CC=C1Cl InChI=1S/C21H20ClNO5/c1-23-7-6-12(17(27)10-23)19-14(24)8-15(25)20-16(26)9-18(28-21(19)20)11-4-2-3-5-13(11)22/h2-5,8-9,12,17,24-25,27H,6-7,10H2,1H3/t12-,17+/m0/s1 BIIVYFLTOXDAOV-YVEFUNNKSA-N belongs to the class of organic compounds known as flavones. These are flavonoids with a structure based on the backbone of 2-phenylchromen-4-one (2-phenyl-1-benzopyran-4-one). Flavones Organic compounds Phenylpropanoids and polyketides Flavonoids Flavones Aromatic heteropolycyclic compounds 1,2-aminoalcohols 1-hydroxy-2-unsubstituted benzenoids 5-hydroxyflavonoids 7-hydroxyflavonoids Aralkylamines Aryl chlorides Azacyclic compounds Chlorobenzenes Chromones Heteroaromatic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds Oxacyclic compounds Phenylpiperidines Pyranones and derivatives Secondary alcohols Trialkylamines Vinylogous acids 1,2-aminoalcohol 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 5-hydroxyflavonoid 7-hydroxyflavonoid Alcohol Amine Aralkylamine Aromatic heteropolycyclic compound Aryl chloride Aryl halide Azacycle Benzenoid Benzopyran Chlorobenzene Chromone Flavone Halobenzene Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organic oxygen compound Organochloride Organohalogen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Phenylpiperidine Piperidine Pyran Pyranone Secondary alcohol Tertiary aliphatic amine Tertiary amine Vinylogous acid dihydroxyflavone hydroxypiperidine monochlorobenzenes logp 2.81 ALOGPS logs -3.63 ALOGPS solubility 9.40e-02 g/l ALOGPS logp 2.48 ChemAxon pka_strongest_acidic 6.71 ChemAxon pka_strongest_basic 7.36 ChemAxon iupac 2-(2-chlorophenyl)-5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]-4H-chromen-4-one ChemAxon average_mass 401.84 ChemAxon mono_mass 401.103000462 ChemAxon smiles CN1CC[C@@H]([C@H](O)C1)C1=C(O)C=C(O)C2=C1OC(=CC2=O)C1=CC=CC=C1Cl ChemAxon formula C21H20ClNO5 ChemAxon inchi InChI=1S/C21H20ClNO5/c1-23-7-6-12(17(27)10-23)19-14(24)8-15(25)20-16(26)9-18(28-21(19)20)11-4-2-3-5-13(11)22/h2-5,8-9,12,17,24-25,27H,6-7,10H2,1H3/t12-,17+/m0/s1 ChemAxon inchikey BIIVYFLTOXDAOV-YVEFUNNKSA-N ChemAxon polar_surface_area 90.23 ChemAxon refractivity 107.74 ChemAxon polarizability 40.85 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 6 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 245487 Specdb::MsMs 245488 Specdb::MsMs 245489 Specdb::MsMs 265434 Specdb::MsMs 265435 Specdb::MsMs 265436