<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">317419</id>
  <title nil="true"/>
  <common-name>3-(4-methoxyphenyl)-n-[(e)-1-[3-(tetrazol-1-yl)phenyl]ethylideneamino]propanamide</common-name>
  <description>3-(4-methoxyphenyl)-n-[(e)-1-[3-(tetrazol-1-yl)phenyl]ethylideneamino]propanamide is a compound with the formula C19H20N6O2. It has an average molecular weight of 364.40 g/mol.</description>
  <cas>478252-01-6</cas>
  <pubchem-id>9649142</pubchem-id>
  <chemical-formula>C19H20N6O2</chemical-formula>
  <weight>364.4</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">2026-08-29T15:32:27Z</created-at>
  <updated-at type="dateTime">2026-08-29T15:32:27Z</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>CC(=NNC(=O)CCC1=CC=C(C=C1)OC)C2=CC(=CC=C2)N3C=NN=N3</moldb-smiles>
  <moldb-formula>C19H20N6O2</moldb-formula>
  <moldb-inchi>InChI=1S/C19H20N6O2/c1-14(16-4-3-5-17(12-16)25-13-20-23-24-25)21-22-19(26)11-8-15-6-9-18(27-2)10-7-15/h3-7,9-10,12-13H,8,11H2,1-2H3,(H,22,26)/b21-14+</moldb-inchi>
  <moldb-inchikey>VGZCAOXKPPJZJB-KGENOOAVSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">364.1647739</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.6</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>CHEM313312</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-(4-methoxyphenyl)-n-[(e)-1-[3-(tetrazol-1-yl)phenyl]ethylideneamino]propanamide</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>Azoles</klass>
  <subklass>Tetrazoles</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0268241</sync-id>
  <structure-inchikey>VGZCAOXKPPJZJB-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>2000004000000000800000000200000800000000002000200000000000000000004000000202200000000000002000000000000000000000000000000000000000000000000000000000000000000020000000000108000204000000000000040000010000010041040000100000000000000908000000000000040000400001044040000000a00000000000000080000000000000000000001100000000040000000000000000000000084000000000000000010000000000000000000080000008000000000000000000000000000000000000004000000230000001000000000040400000000040000000000400000000000000004000000000000000</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�	
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��������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:23:15Z</structure-indexed-at>
</compound>
