1.0 2016-09-30 23:14:29 UTC 2020-04-22 15:15:04 UTC BMDB0004999 BMDB04999 Loperamide Loperamida Loperamidum Diamide Apo-loperamide Imodium a-D Imodium a-D caplets Kaopectate II Loperacap Loperamide hydrochloride Maalox anti-diarrheal Nu-loperamide PMS-Loperamide Rho-loperamide Hydrochloride, loperamide Imodium Monohydrochloride, loperamide Loperamide monohydrochloride C29H33ClN2O2 477.038 476.223056017 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N,N-dimethyl-2,2-diphenylbutanamide imodium 53179-11-6 CN(C)C(=O)C(CCN1CCC(O)(CC1)C1=CC=C(Cl)C=C1)(C1=CC=CC=C1)C1=CC=CC=C1 InChI=1S/C29H33ClN2O2/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23/h3-16,34H,17-22H2,1-2H3 RDOIQAHITMMDAJ-UHFFFAOYSA-N belongs to the class of organic compounds known as diphenylmethanes. Diphenylmethanes are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups. Organic compounds Benzenoids Benzene and substituted derivatives Diphenylmethanes Diphenylmethanes Amino acids and derivatives Aralkylamines Aryl chlorides Azacyclic compounds Carbonyl compounds Chlorobenzenes Hydrocarbon derivatives N-acyl amines Organic oxides Organochlorides Organopnictogen compounds Phenylacetamides Phenylpiperidines Tertiary alcohols Tertiary carboxylic acid amides Trialkylamines Alcohol Amine Amino acid or derivatives Aralkylamine Aromatic heteromonocyclic compound Aryl chloride Aryl halide Azacycle Carbonyl group Carboxamide group Carboxylic acid derivative Chlorobenzene Diphenylmethane Halobenzene Hydrocarbon derivative N-acyl-amine Organic nitrogen compound Organic oxide Organic oxygen compound Organochloride Organohalogen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenylacetamide Phenylpiperidine Piperidine Tertiary alcohol Tertiary aliphatic amine Tertiary amine Tertiary carboxylic acid amide Aromatic heteromonocyclic compounds monocarboxylic acid amide monochlorobenzenes piperidines tertiary alcohol Solid logp 4.44 ALOGPS logs -5.74 ALOGPS logp 4.77 ChemAxon pka_strongest_acidic 13.96 ChemAxon pka_strongest_basic 9.41 ChemAxon iupac 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N,N-dimethyl-2,2-diphenylbutanamide ChemAxon average_mass 477.038 ChemAxon mono_mass 476.223056017 ChemAxon smiles CN(C)C(=O)C(CCN1CCC(O)(CC1)C1=CC=C(Cl)C=C1)(C1=CC=CC=C1)C1=CC=CC=C1 ChemAxon formula C29H33ClN2O2 ChemAxon inchi InChI=1S/C29H33ClN2O2/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23/h3-16,34H,17-22H2,1-2H3 ChemAxon inchikey RDOIQAHITMMDAJ-UHFFFAOYSA-N ChemAxon polar_surface_area 43.78 ChemAxon refractivity 139.32 ChemAxon polarizability 52.59 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon number_of_rings 4 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::NmrOneD 2014 Specdb::NmrTwoD 1949 Specdb::CMs 17142 Specdb::CMs 38832 Specdb::CMs 132826 Specdb::CMs 140560 Specdb::MsMs 2430 Specdb::MsMs 2431 Specdb::MsMs 2432 Specdb::MsMs 6054 Specdb::MsMs 6055 Specdb::MsMs 6056 Specdb::MsMs 6057 Specdb::MsMs 6058 Specdb::MsMs 6059 Specdb::MsMs 6060 Specdb::MsMs 245409 Specdb::MsMs 245410 Specdb::MsMs 245411 Specdb::MsMs 265356 Specdb::MsMs 265357 Specdb::MsMs 265358 Specdb::MsMs 446445 Specdb::MsMs 446446 Specdb::MsMs 446447 Specdb::MsMs 446448 Specdb::MsMs 446449 Specdb::MsMs 447240 Specdb::MsMs 450506 Specdb::MsMs 452342 Specdb::MsMs 2244847 DB00836 FDB023576 3818 3955 C07080 6532 Loperamide 1016 Chu, Chi-Ya; Hsu, Li-Ying; Wang, Mei-Li; Hsu, Kuo-Ying. Synthesis of the new antidiarrheal drug-loperamide. Huadong Huagong Xueyuan Xuebao (1981), (1), 143-6. CODEN: HHKPDM ISSN:0253-9683. CAN 95:115232 AN 1981:515232