335027 <common-name>2-amino-1-(4-chlorophenyl)-7,7-dimethyl-5-oxo-4-pyridin-3-yl-6,8-dihydro-4h-quinoline-3-carbonitrile</common-name> <description>2-amino-1-(4-chlorophenyl)-7,7-dimethyl-5-oxo-4-pyridin-3-yl-6,8-dihydro-4h-quinoline-3-carbonitrile is a chemical compound with the formula C23H21ClN4O. It has an average molecular weight of 404.90 g/mol.</description> <cas>311318-20-4</cas> <pubchem-id>3508604</pubchem-id> <chemical-formula>C23H21ClN4O</chemical-formula> <weight>404.9</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">2026-08-30T16:59:51Z</created-at> <updated-at type="dateTime">2026-08-30T16:59:51Z</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>CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)Cl)N)C#N)C4=CN=CC=C4)C(=O)C1)C</moldb-smiles> <moldb-formula>C23H21ClN4O</moldb-formula> <moldb-inchi>InChI=1S/C23H21ClN4O/c1-23(2)10-18-21(19(29)11-23)20(14-4-3-9-27-13-14)17(12-25)22(26)28(18)16-7-5-15(24)6-8-16/h3-9,13,20H,10-11,26H2,1-2H3</moldb-inchi> <moldb-inchikey>YGKKOKKOSGOTFV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">404.140389</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.1</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>CHEM330920</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-chlorophenyl)-7,7-dimethyl-5-oxo-4-pyridin-3-yl-6,8-dihydro-4h-quinoline-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>CED0285502</sync-id> <structure-inchikey>YGKKOKKOSGOTFV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000000000000000000000004000000000000004080084100000000000000000020000000040000002001000000000004000000000000000000000000000000400000000100000000000020000020400000001000000005000000000200000080000000000000000000000000020108000000000000000000100000100048020080800000000000800000001080000000000000000000000021000004000000000000000000088000000000040000004000000100000000000100000000000220001000000000200001000012000000000000000200000000000000000040000000002040000200000000000000000000000000000000000000</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�B������������������� �� � �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:36:47Z</structure-indexed-at> </compound>