331330 <common-name>1-(4,4-diphenylbut-3-enyl)-3,6-dihydro-2h-pyridine-5-carboxylic acid</common-name> <description>1-(4,4-diphenylbut-3-enyl)-3,6-dihydro-2h-pyridine-5-carboxylic acid is a chemical compound with the formula C22H23NO2. It has an average molecular weight of 333.40 g/mol.</description> <cas>85375-88-8</cas> <pubchem-id>134985</pubchem-id> <chemical-formula>C22H23NO2</chemical-formula> <weight>333.4</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-08-30T12:06:40Z</created-at> <updated-at type="dateTime">2026-08-30T12:06:40Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>C1CN(CC(=C1)C(=O)O)CCC=C(C2=CC=CC=C2)C3=CC=CC=C3</moldb-smiles> <moldb-formula>C22H23NO2</moldb-formula> <moldb-inchi>InChI=1S/C22H23NO2/c24-22(25)20-13-7-15-23(17-20)16-8-14-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-14H,7-8,15-17H2,(H,24,25)</moldb-inchi> <moldb-inchikey>NNHFTYXKYCVPFN-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">333.172879</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.4</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM327223</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>1-(4,4-diphenylbut-3-enyl)-3,6-dihydro-2h-pyridine-5-carboxylic acid</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Diphenylmethanes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0281868</sync-id> <structure-inchikey>NNHFTYXKYCVPFN-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000000000000000000000004000000000000000000000400000000000000000000000000000600400000000000008000010000000000000000000000000000000000000000002000000000020000400000200000000000000001000000000000000000000000000002010000000000000000000000000020000000000080000000000000500200000000210000000000000001000000000000000000000000000008400000000000000000000000800000000000a000000000000000000000000000000800000000000000000000000200000004010000000000000000000050000000000400000020000000004000000004000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������(�������h��������(�������(�������h��������`�������`�������h��������(������@(������@h�������@h�������@h�������@h�������@h�������@(������@h�������@h�������@h�������@h�������@h���������������������(��� ��(��� � � � ����(�� �h���h���h���h���h��� ��h���h���h���h���h����� h���h�B����������������� �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:33:50Z</structure-indexed-at> </compound>