348963 <common-name>2-amino-1-(4-chloro-3-nitrophenyl)-5-oxo-7-phenyl-4-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile</common-name> <description>2-amino-1-(4-chloro-3-nitrophenyl)-5-oxo-7-phenyl-4-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile is a chemical compound with the formula C29H20ClF3N4O3. With an average molecular weight of 564.90 g/mol, 2-amino-1-(4-chloro-3-nitrophenyl)-5-oxo-7-phenyl-4-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile is a heavy molecule.</description> <cas>476483-54-2</cas> <pubchem-id>3584546</pubchem-id> <chemical-formula>C29H20ClF3N4O3</chemical-formula> <weight>564.9</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">2026-08-31T13:16:10Z</created-at> <updated-at type="dateTime">2026-08-31T13:16:10Z</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>C1C(CC(=O)C2=C1N(C(=C(C2C3=CC=CC=C3C(F)(F)F)C#N)N)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C5=CC=CC=C5</moldb-smiles> <moldb-formula>C29H20ClF3N4O3</moldb-formula> <moldb-inchi>InChI=1S/C29H20ClF3N4O3/c30-22-11-10-18(14-23(22)37(39)40)36-24-12-17(16-6-2-1-3-7-16)13-25(38)27(24)26(20(15-34)28(36)35)19-8-4-5-9-21(19)29(31,32)33/h1-11,14,17,26H,12-13,35H2</moldb-inchi> <moldb-inchikey>GZAYSHJIBWLPTO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">564.1176027</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.4</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>CHEM344856</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-(4-chloro-3-nitrophenyl)-5-oxo-7-phenyl-4-[2-(trifluoromethyl)phenyl]-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>CED0299290</sync-id> <structure-inchikey>GZAYSHJIBWLPTO-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1000000080800000000000002000000000000000000000005000014100000200000000000c20000000002002100004000000100000000000000000020000000000000000400000000100000000000020002020400000001800000001402000000200004000000200000000110000000010020100000000000000000000101000000000000080800000000000800002005000001100000000000000000001000000000000000000000000088000000010000000044000000000000000000000000000000240000000800000200001000012000000000000000200000000000000000040000000000040000200000000800000001000000000800000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ����������������(���,���€���`�������`�������`�������(�������(�������(�������(�������(�������(�������(�������`������@(������@h�������@h�������@h�������@h�������@(������� ���� � ���� � ���� � ������(�������(�������h�������@(������@h�������@(������@(������@h�������@h�������� ����� *��������(������ *���ÿ���@(������@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">2026-09-19T05:47:10Z</structure-indexed-at> </compound>