315577 <common-name>(5z)-5-[(3-chlorophenyl)methylidene]-2-methyl-3-(5-phenyl-1,3,4-thiadiazol-2-yl)imidazol-4-one</common-name> <description>(5z)-5-[(3-chlorophenyl)methylidene]-2-methyl-3-(5-phenyl-1,3,4-thiadiazol-2-yl)imidazol-4-one is a chemical compound with the formula C19H13ClN4OS. It has an average molecular weight of 380.90 g/mol.</description> <cas>100037-26-1</cas> <pubchem-id>6447763</pubchem-id> <chemical-formula>C19H13ClN4OS</chemical-formula> <weight>380.9</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">2026-08-29T13:00:11Z</created-at> <updated-at type="dateTime">2026-08-29T13:00:11Z</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=NC(=CC2=CC(=CC=C2)Cl)C(=O)N1C3=NN=C(S3)C4=CC=CC=C4</moldb-smiles> <moldb-formula>C19H13ClN4OS</moldb-formula> <moldb-inchi>InChI=1S/C19H13ClN4OS/c1-12-21-16(11-13-6-5-9-15(20)10-13)18(25)24(12)19-23-22-17(26-19)14-7-3-2-4-8-14/h2-11H,1H3/b16-11-</moldb-inchi> <moldb-inchikey>KIXYAUDYQBLUHA-WJDWOHSUSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">380.0498599</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>CHEM311470</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>(5z)-5-[(3-chlorophenyl)methylidene]-2-methyl-3-(5-phenyl-1,3,4-thiadiazol-2-yl)imidazol-4-one</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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0266434</sync-id> <structure-inchikey>KIXYAUDYQBLUHA-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>82000000000000000000000000000024000000000000800000000000000040000000200000000000000020040000000000000000000000000000000000000000004000000080000000000000200000100002001002000080000000000000000000100000000000001100000000000101000000000000000000000000010000400000008000000000000000008800000001002000000000000000000000000000000000804000000a0000000000000000000000000000000000400000000000000000004000400020000000000012000000002000000220008000000000000000000000000040000000000000020000000000000002000010004000</structure-fingerprint> <structure-pattern-fingerprint>549608400d52864181840b408128a04001001400812520000e3520c08224484c440208d4128000000d80c10820c000000c600225c0cc32010024e4f100a0c008c7110c4012b0041000901000407202100844058053011b32c0440c6240a248000c3805270048021060000401d5958200228280718919c0043538086002510002104000184ef08208180602520a2c0008191c081244501e821000082008500084d0c350308090c00020000962057c27100ac040008b41084018004a1008c80210805002a60590403201c00504143502802c010000620056200d10028418800b209010441018c90084000004015116200000900130d042042e0000108058020047</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���h���h���h��� �h���h���h�B�������������� ������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:21:47Z</structure-indexed-at> </compound>