346347 <common-name>2-amino-1-(3-cyano-5,6,7,8-tetrahydro-4h-cyclohepta[b]thiophen-2-yl)-4-(3-hydroxy-4-methoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile</common-name> <description>2-amino-1-(3-cyano-5,6,7,8-tetrahydro-4h-cyclohepta[b]thiophen-2-yl)-4-(3-hydroxy-4-methoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile is a chemical compound with the formula C27H26N4O3S. It has an average molecular weight of 486.60 g/mol.</description> <cas>476483-94-0</cas> <pubchem-id>4147654</pubchem-id> <chemical-formula>C27H26N4O3S</chemical-formula> <weight>486.6</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">2026-08-31T09:45:45Z</created-at> <updated-at type="dateTime">2026-08-31T09:45:45Z</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>COC1=C(C=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C5=C(S4)CCCCC5)C#N)N)C#N)O</moldb-smiles> <moldb-formula>C27H26N4O3S</moldb-formula> <moldb-inchi>InChI=1S/C27H26N4O3S/c1-34-22-11-10-15(12-21(22)33)24-18(14-29)26(30)31(19-7-5-8-20(32)25(19)24)27-17(13-28)16-6-3-2-4-9-23(16)35-27/h10-12,24,33H,2-9,30H2,1H3</moldb-inchi> <moldb-inchikey>RJGUOIGBJAYDOG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">486.1725619</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.8</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>CHEM342240</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>2-amino-1-(3-cyano-5,6,7,8-tetrahydro-4h-cyclohepta[b]thiophen-2-yl)-4-(3-hydroxy-4-methoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile</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>Quinolines and derivatives</klass> <subklass>Phenylquinolines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0296700</sync-id> <structure-inchikey>RJGUOIGBJAYDOG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000000000a080000000000200000000000000002000000000004408000100400000000000000220000000000240000000000000000000000200040000000000000000000000000000000100000000000020001030400100000000000001000000000200010001000040000001100008000000020100000000000000000000100800000040000080000000000000800000001000000000000000008000000001000000000000000400000000089100000000040000004000000000001000000080000000000200002100000000000000408002000000000000200210000000000010004000000000000040000200000000000000000020000000000000000000</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����B������������ �� ������� ������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:45:06Z</structure-indexed-at> </compound>