307444 <common-name>(e)-3-(3-hydroxy-1h-indol-2-yl)-2-(4-methylpiperazine-1-carboximidoyl)prop-2-enenitrile</common-name> <description>(e)-3-(3-hydroxy-1h-indol-2-yl)-2-(4-methylpiperazine-1-carboximidoyl)prop-2-enenitrile is a chemical compound with the formula C17H19N5O. It has an average molecular weight of 309.40 g/mol.</description> <cas>171853-07-9</cas> <pubchem-id>135543184</pubchem-id> <chemical-formula>C17H19N5O</chemical-formula> <weight>309.4</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">2026-08-29T01:34:18Z</created-at> <updated-at type="dateTime">2026-08-29T01:34:18Z</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>CN1CCN(CC1)C(=N)C(=CC2=C(C3=CC=CC=C3N2)O)C#N</moldb-smiles> <moldb-formula>C17H19N5O</moldb-formula> <moldb-inchi>InChI=1S/C17H19N5O/c1-21-6-8-22(9-7-21)17(19)12(11-18)10-15-16(23)13-4-2-3-5-14(13)20-15/h2-5,10,19-20,23H,6-9H2,1H3/b12-10+,19-17?</moldb-inchi> <moldb-inchikey>ILIBKEDXRYSWSQ-CUYZKFRNSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">309.1589603</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.4</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>CHEM303337</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>(e)-3-(3-hydroxy-1h-indol-2-yl)-2-(4-methylpiperazine-1-carboximidoyl)prop-2-enenitrile</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 nil="true"/> <superklass nil="true"/> <klass nil="true"/> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0258490</sync-id> <structure-inchikey>ILIBKEDXRYSWSQ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20000000000000000000000000100000000000000100000210000000000000000000000000000000002000000000000000000000000000000000000000000000000000000000000000000000100000000000020000200800002002000000000000200112000000000000000000000000000020100000000000400000000000010000040000100800080200000004000000000000104000000080000000000000010000000000000040000088000000000000000000000008000000000000000000000040004002000000000000000002000000000000000006200000001000000010000000000000040000000000000000000000000000000004000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`������� ������`�������`�������(�������`�������`�������(�������h��������(�������h�������@(������@(������@(������@h�������@h�������@h�������@h�������@(������@8��������h��������(�������(�������������������������� ��(�� (� � ��h�� h� �h���h���h���h���h���h��� � ��(������h�� h�B���������������� ������ ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:15:37Z</structure-indexed-at> </compound>