337400 <common-name>Ethyl 2-methyl-2-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-1-yl]propanoate</common-name> <description>Ethyl 2-methyl-2-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-1-yl]propanoate is a compound with the chemical formula C23H35F3N4O2. It has an average molecular weight of 456.50 g/mol.</description> <cas nil="true"/> <pubchem-id>3049818</pubchem-id> <chemical-formula>C23H35F3N4O2</chemical-formula> <weight>456.5</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">2026-08-30T20:13:22Z</created-at> <updated-at type="dateTime">2026-08-30T20:13:22Z</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>CCOC(=O)C(C)(C)N1CCN(CC1)CCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F</moldb-smiles> <moldb-formula>C23H35F3N4O2</moldb-formula> <moldb-inchi>InChI=1S/C23H35F3N4O2/c1-4-32-21(31)22(2,3)30-16-12-28(13-17-30)9-8-27-10-14-29(15-11-27)20-7-5-6-19(18-20)23(24,25)26/h5-7,18H,4,8-17H2,1-3H3</moldb-inchi> <moldb-inchikey>MYIZHCKTKCIOOQ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">456.2712109</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.5</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>CHEM333293</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>Ethyl 2-methyl-2-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-1-yl]propanoate</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>Diazinanes</klass> <subklass>Piperazines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0287840</sync-id> <structure-inchikey>MYIZHCKTKCIOOQ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000022080000000200000001000000000200000000000000000000000000200000000000000000000000080014000000000000000000000800000000000000000000000000000000000002000000001018000000000000000000000000001400000000000000010000000000002010000000000000000000000000100404000000180000000000000400000000000000000000002000009000000000000040000000000000008000000004000004004000000a000000800200000000000000000000000000000000000000000000000002000000200000000010000000040000000000040000000000400800000000000000000000040000000</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�B������ �� ������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:38:32Z</structure-indexed-at> </compound>