287360 <common-name>8,9,10,11-tetrahydro-7h-benzo[b][1,4]benzodiazepine</common-name> <description>8,9,10,11-tetrahydro-7h-benzo[b][1,4]benzodiazepine belongs to the benzodiazepines, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C13H14N2 and an average molecular weight of 198.26 g/mol.</description> <cas nil="true"/> <pubchem-id>39454</pubchem-id> <chemical-formula>C13H14N2</chemical-formula> <weight>198.26</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">2026-08-27T23:45:53Z</created-at> <updated-at type="dateTime">2026-08-27T23:45:53Z</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>C1CCC2=C(C1)C=NC3=CC=CC=C3N2</moldb-smiles> <moldb-formula>C13H14N2</moldb-formula> <moldb-inchi>InChI=1S/C13H14N2/c1-2-6-11-10(5-1)9-14-12-7-3-4-8-13(12)15-11/h3-4,7-9,15H,1-2,5-6H2</moldb-inchi> <moldb-inchikey>ZLYVOWHTMHOOGG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">198.1156985</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.4</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>CHEM283253</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>8,9,10,11-tetrahydro-7h-benzo[b][1,4]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>Benzodiazepines</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0239139</sync-id> <structure-inchikey>ZLYVOWHTMHOOGG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000000000000000000004000000000000000004000000000000200000000000000002000000000000000800000000000000000000000010080000000000000000000000000000000000000000000000000000000000000000020000000000000000000000000020000800008000000000000000800000008000000800000200000002000000000000100000000000000000000000000000000000000000000080000000000080080000002000000000000000040000000000000000000000004000000000000000000000000200200000000000000000000000000000040000000000000000080000000020000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAPAAAAEQAAAIABBgBgAAAAAgIGAGAAAAAC AgYAYAAAAAICBgAoAAAAAwQGACgAAAADBAYAYAAAAAICBgBoAAAAAwMBBwAo AAAAAwMGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAA AAMDAQZAKAAAAAMEBwBoAAAAAwIBCwABAAECAAIDAAMEKAIEBQAEBiAGBygC BwggCAloDAkKaAwKC2gMCwxoDAwNaAwNDiAFAAAOAyANCGgMQgMAAAAGAAUE AwIBBwYEAw4NCAcGCQoLDA0IFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:00:44Z</structure-indexed-at> </compound>