325672 <common-name>9-chloro-4-methyl-1-naphthalen-2-yl-5,6-dihydro-4h-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine</common-name> <description>9-chloro-4-methyl-1-naphthalen-2-yl-5,6-dihydro-4h-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine is a chemical compound with the formula C21H17ClN4. It has an average molecular weight of 360.80 g/mol.</description> <cas>54028-84-1</cas> <pubchem-id>3041408</pubchem-id> <chemical-formula>C21H17ClN4</chemical-formula> <weight>360.8</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">2026-08-30T03:34:38Z</created-at> <updated-at type="dateTime">2026-08-30T03:34:38Z</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>CC1CNC2=C(C=C(C=C2)Cl)N3C1=NN=C3C4=CC5=CC=CC=C5C=C4</moldb-smiles> <moldb-formula>C21H17ClN4</moldb-formula> <moldb-inchi>InChI=1S/C21H17ClN4/c1-13-12-23-18-9-8-17(22)11-19(18)26-20(13)24-25-21(26)16-7-6-14-4-2-3-5-15(14)10-16/h2-11,13,23H,12H2,1H3</moldb-inchi> <moldb-inchikey>WKENAQGTHFKQGP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">360.1141743</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5</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>CHEM321565</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>9-chloro-4-methyl-1-naphthalen-2-yl-5,6-dihydro-4h-[1,2,4]triazolo[4,3-a][1,5]benzodiazepine</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>Triazolodiazepines</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0276301</sync-id> <structure-inchikey>WKENAQGTHFKQGP-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000000000020000000000000000000000400001000180080000000000000000000000000200000000002002100000000000000000000020000000000000000000000400000000200000000000000000000000000000100000000000000000000000080000000000000120000800000020100000000000000001000100000000140000001800000200000000000880000010100000000000000000000000100040000000000000000080000000000000000200000000200000800000000000002000000020000000000000000000010000000002000000200000000000000000000000001002040000000000000000000000000020040000000000000</structure-fingerprint> 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B2gMBwhoDAgJaAwHCgAFCyALDGgMDA1oDA0OaAwOD2gMDxAgEBFoDBESaAwS E2gMExRoDBQVaAwVFmgMFhdoDBcYaAwYGWgMDAEACQRoDA8LaAwZEGgMFxJo DEIFAAAABwECAwQFCwwGBgcICQQFBQ0MCw8OBhESFxgZEAYTFBUWFxIXBAAA AAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:29:31Z</structure-indexed-at> </compound>