339044 <common-name>2-amino-1-(3-bromophenyl)-4-(5-ethylthiophen-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4h-quinoline-3-carbonitrile</common-name> <description>2-amino-1-(3-bromophenyl)-4-(5-ethylthiophen-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4h-quinoline-3-carbonitrile is a chemical compound with the formula C24H24BrN3OS. It has an average molecular weight of 482.40 g/mol.</description> <cas>441783-25-1</cas> <pubchem-id>5051409</pubchem-id> <chemical-formula>C24H24BrN3OS</chemical-formula> <weight>482.4</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">2026-08-30T22:15:12Z</created-at> <updated-at type="dateTime">2026-08-30T22:15:12Z</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>CCC1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC(=CC=C4)Br)N)C#N</moldb-smiles> <moldb-formula>C24H24BrN3OS</moldb-formula> <moldb-inchi>InChI=1S/C24H24BrN3OS/c1-4-16-8-9-20(30-16)21-17(13-26)23(27)28(15-7-5-6-14(25)10-15)18-11-24(2,3)12-19(29)22(18)21/h5-10,21H,4,11-12,27H2,1-3H3</moldb-inchi> <moldb-inchikey>YPTNIRANGSTZRS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">481.08235</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.8</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>CHEM334937</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-bromophenyl)-4-(5-ethylthiophen-2-yl)-7,7-dimethyl-5-oxo-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>CED0289469</sync-id> <structure-inchikey>YPTNIRANGSTZRS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1000000080000000800000000000000004002000400000004000080100000000000002000020000000040000000001000000000000000000000004000080000000000000000000000100000000000020801030400000000000800001000200000200000000000000000000100000000400020108000000000000000000100001004048000080800000000000800000001000000000001000000000000020000004000000000000000000088000000000000000004000000100000000000000000000000200000000000100200000000002000000000000020200000000000100004040000000000040000200000000000000000000000000000002080004</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�B������������ ���� ����������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:39:39Z</structure-indexed-at> </compound>