64813 <common-name>3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-thienyl)-, diethyl ester</common-name> <description>3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-thienyl)-, diethyl ester belongs to the hydropyridines, a subclass of pyridines and derivatives within the organic compounds. This organoheterocyclic compound has the formula C17H21N1O4S1 and an average molecular weight of 335.42 g/mol.</description> <cas>23118-58-3</cas> <pubchem-id>211447</pubchem-id> <chemical-formula>C17H21N1O4S1</chemical-formula> <weight>335.4</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">2026-04-03T03:11:45Z</created-at> <updated-at type="dateTime">2026-08-19T20:57:46Z</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>CCOC(=O)C1=C(C)NC(C)=C(C1C1=CC=CS1)C(=O)OCC</moldb-smiles> <moldb-formula>C17H21N1O4S1</moldb-formula> <moldb-inchi>InChI=1S/C17H21NO4S/c1-5-21-16(19)13-10(3)18-11(4)14(17(20)22-6-2)15(13)12-8-7-9-23-12/h7-9,15,18H,5-6H2,1-4H3</moldb-inchi> <moldb-inchikey>JCHPOTOEIRYEPD-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">335.42</moldb-average-mass> <moldb-mono-mass type="decimal">335.119129</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>183299</chemspider-id> <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>CHEM060706</chemdb-id> <dsstox-id>DTXSID80177688</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00017081</susdat-id> <iupac>diethyl 2,6-dimethyl-4-thiophen-2-yl-1,4-dihydropyridine-3,5-dicarboxylate</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>Organoheterocyclic compounds</superklass> <klass>Pyridines and derivatives</klass> <subklass>Hydropyridines</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0092936</sync-id> <structure-inchikey>JCHPOTOEIRYEPD-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20000000000000000800000000000000050000000400000000000000040000000000002000000000000000000000100000000000000000000000000000000000000000000000000000000000000000060000014000100000000000000010000000000010000000000000000000000000000000000000000000000000400100000000048000000800000200000000000001000000000000000020000000000000000000040000000000000080100000000000000000080000000000800000000000001000000000000000000001000000000000000002000000200000000000000000000000000000040000000000400000000080000000000000000000000</structure-fingerprint> 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