311402 <common-name>9,19-diazapentacyclo[10.7.0.02,9.03,7.013,18]nonadeca-1(12),4,13,15,17-pentaene-5-carbonitrile</common-name> <description>9,19-diazapentacyclo[10.7.0.02,9.03,7.013,18]nonadeca-1(12),4,13,15,17-pentaene-5-carbonitrile is a chemical compound with the formula C18H17N3. It has an average molecular weight of 275.30 g/mol.</description> <cas nil="true"/> <pubchem-id>14345939</pubchem-id> <chemical-formula>C18H17N3</chemical-formula> <weight>275.3</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">2026-08-29T07:36:50Z</created-at> <updated-at type="dateTime">2026-08-29T07:36:50Z</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>C1CN2CC3CC(=CC3C2C4=C1C5=CC=CC=C5N4)C#N</moldb-smiles> <moldb-formula>C18H17N3</moldb-formula> <moldb-inchi>InChI=1S/C18H17N3/c19-9-11-7-12-10-21-6-5-14-13-3-1-2-4-16(13)20-17(14)18(21)15(12)8-11/h1-4,8,12,15,18,20H,5-7,10H2</moldb-inchi> <moldb-inchikey>FLJQHUQYKKKXFK-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">275.1422476</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>CHEM307295</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>9,19-diazapentacyclo[10.7.0.02,9.03,7.013,18]nonadeca-1(12),4,13,15,17-pentaene-5-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>Indoles and derivatives</klass> <subklass>Pyridoindoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0262359</sync-id> <structure-inchikey>FLJQHUQYKKKXFK-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1400000001000000000000000000000000000100000000000000000000000000000000400000000000000040000000000000000000000000000000000000004000000000000000000000200000100000c0001000000000000200000080000001000000000000000002020100000000002000000000102000000080000002800000200001800000000000000100000000080000000000000010000000000004040000088000000000000000000000008000000000000000000000040000000000000000000000000000000000000000204200000001000000010001000002000040000000000000000000000000080000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`�������`�������(�������h��������`�������`������@(������@(������@(������@h�������@h�������@h�������@h�������@(������@8��������(�������(��������������������������(����� � � �h���h�� h� �h���h���h���h���h��� ��(���� ������ h���h�B������� ����� ��������� ���������� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:18:36Z</structure-indexed-at> </compound>