352066 <common-name>7-(2-cyano-4-phenyl-2,3,4,5-tetrahydro-1h-1,5-benzodiazepin-7-yl)-4-phenyl-2,3,4,5-tetrahydro-1h-1,5-benzodiazepine-2-carbonitrile</common-name> <description>7-(2-cyano-4-phenyl-2,3,4,5-tetrahydro-1h-1,5-benzodiazepin-7-yl)-4-phenyl-2,3,4,5-tetrahydro-1h-1,5-benzodiazepine-2-carbonitrile is a chemical compound with the formula C32H28N6. It has an average molecular weight of 496.60 g/mol.</description> <cas>87896-39-7</cas> <pubchem-id>3071398</pubchem-id> <chemical-formula>C32H28N6</chemical-formula> <weight>496.6</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">2026-08-31T18:11:19Z</created-at> <updated-at type="dateTime">2026-08-31T18:11:19Z</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>C1C(NC2=C(C=C(C=C2)C3=CC4=C(C=C3)NC(CC(N4)C5=CC=CC=C5)C#N)NC1C6=CC=CC=C6)C#N</moldb-smiles> <moldb-formula>C32H28N6</moldb-formula> <moldb-inchi>InChI=1S/C32H28N6/c33-19-25-17-29(21-7-3-1-4-8-21)37-31-15-23(11-13-27(31)35-25)24-12-14-28-32(16-24)38-30(18-26(20-34)36-28)22-9-5-2-6-10-22/h1-16,25-26,29-30,35-38H,17-18H2</moldb-inchi> <moldb-inchikey>ZWGMNHZTXJZGDK-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">496.2375449</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.4</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>CHEM347959</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>7-(2-cyano-4-phenyl-2,3,4,5-tetrahydro-1h-1,5-benzodiazepin-7-yl)-4-phenyl-2,3,4,5-tetrahydro-1h-1,5-benzodiazepine-2-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>Benzodiazepines</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0302356</sync-id> <structure-inchikey>ZWGMNHZTXJZGDK-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>12020000000000000000000000000000000000000000000000000000000040000004400000000000004000000000000000000008000000000000000000000000000000000000000000000000020000000000000000000000010004200000000000080000000100000800000020000000000000000000000100000000010000000804000200000004200800000000100000000000000000001000800000000000000000000088000000000000000000000000000000000000000000000004000000000000000000001000000000000000000020200000000000000000000000000000040000000000000000000000000020000000000000000</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�B�������������������� �� � ����������������� !"#�����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:49:53Z</structure-indexed-at> </compound>