<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">351227</id>
  <title nil="true"/>
  <common-name>[1-[(e)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]naphthalen-2-yl] 4-methylbenzoate</common-name>
  <description>[1-[(e)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]naphthalen-2-yl] 4-methylbenzoate is a chemical compound with the formula C31H24N2O3. It has an average molecular weight of 472.50 g/mol.</description>
  <cas>767320-46-7</cas>
  <pubchem-id>9630424</pubchem-id>
  <chemical-formula>C31H24N2O3</chemical-formula>
  <weight>472.5</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">2026-08-31T16:48:35Z</created-at>
  <updated-at type="dateTime">2026-08-31T16:48:35Z</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>CC1=CC=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)C=NNC(=O)CC4=CC=CC5=CC=CC=C54</moldb-smiles>
  <moldb-formula>C31H24N2O3</moldb-formula>
  <moldb-inchi>InChI=1S/C31H24N2O3/c1-21-13-15-24(16-14-21)31(35)36-29-18-17-23-8-3-5-12-27(23)28(29)20-32-33-30(34)19-25-10-6-9-22-7-2-4-11-26(22)25/h2-18,20H,19H2,1H3,(H,33,34)/b32-20+</moldb-inchi>
  <moldb-inchikey>VQOBJLMYRMULLG-UZWMFBFFSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">472.1786926</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>7</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>CHEM347120</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>[1-[(e)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]naphthalen-2-yl] 4-methylbenzoate</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>Benzenoids</superklass>
  <klass>Naphthalenes</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0301527</sync-id>
  <structure-inchikey>VQOBJLMYRMULLG-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000800200000000000040000000000000100800001000010000000000000202040000020000000000000000000040000010000000000000000000000000000000000002000000000060000000000300000004000000000000000000010000000000000080000000000000480000000000000000000000000001000040000001800080000000000080000000000100000000000000000000000000000200000004040000086000000000000000000000000000008000000000000000040000040000000000000000000000004000002040000200000000000000000100000001001048000000000480000000000020000000000000000000</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��� ��(��	 	
 
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h���h�#�h�#�h�B��������������������
��������#��� !"#�����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:49:09Z</structure-indexed-at>
</compound>
