345794 <common-name>3,5-diphenyl-3,4,13-triazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),2(6),4,7,9,11,14,16-octaene</common-name> <description>3,5-diphenyl-3,4,13-triazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),2(6),4,7,9,11,14,16-octaene is a chemical compound with the formula C27H19N3. It has an average molecular weight of 385.50 g/mol.</description> <cas nil="true"/> <pubchem-id>3069658</pubchem-id> <chemical-formula>C27H19N3</chemical-formula> <weight>385.5</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">2026-08-31T08:47:24Z</created-at> <updated-at type="dateTime">2026-08-31T08:47:24Z</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>C1=CC=C(C=C1)C2=NN(C3=C2C4=CC=CC=C4NC5=CC=CC=C53)C6=CC=CC=C6</moldb-smiles> <moldb-formula>C27H19N3</moldb-formula> <moldb-inchi>InChI=1S/C27H19N3/c1-3-11-19(12-4-1)26-25-21-15-7-9-17-23(21)28-24-18-10-8-16-22(24)27(25)30(29-26)20-13-5-2-6-14-20/h1-18,28H</moldb-inchi> <moldb-inchikey>JCFSTMXHBLXIQC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">385.1578976</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.5</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>CHEM341687</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>3,5-diphenyl-3,4,13-triazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),2(6),4,7,9,11,14,16-octaene</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>Benzazepines</klass> <subklass>Dibenzazepines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0296149</sync-id> <structure-inchikey>JCFSTMXHBLXIQC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200000000000000000000000000000000000040000000100000008800002004000000000000000000210000000000000000000000000000000000000000000000000000000000000000018000000000000000000000000000000000000000000000000100000000000080000000000000004008000000800000200000000000800000000100000000001000000000000000000000000000000000080000000000000080000002000000000000000000000000000000000000000000000400000100000000000000001a00000000000000000040000008000040000000000000000000080000020000000000000000</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���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">2026-09-19T05:44:44Z</structure-indexed-at> </compound>