321716 <common-name>6-(2-methoxyethoxymethyl)-3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-a]phthalazine</common-name> <description>6-(2-methoxyethoxymethyl)-3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-a]phthalazine is a chemical compound with the formula C20H20N4O3. It has an average molecular weight of 364.40 g/mol.</description> <cas>98124-13-1</cas> <pubchem-id>3062462</pubchem-id> <chemical-formula>C20H20N4O3</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">2026-08-29T21:21:07Z</created-at> <updated-at type="dateTime">2026-08-29T21:21:07Z</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>COCCOCC1=NN2C(=NN=C2C3=CC=CC=C31)C4=CC=C(C=C4)OC</moldb-smiles> <moldb-formula>C20H20N4O3</moldb-formula> <moldb-inchi>InChI=1S/C20H20N4O3/c1-25-11-12-27-13-18-16-5-3-4-6-17(16)20-22-21-19(24(20)23-18)14-7-9-15(26-2)10-8-14/h3-10H,11-13H2,1-2H3</moldb-inchi> <moldb-inchikey>YSKCSMCLWKOPTC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">364.1535405</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.2</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>CHEM317609</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>6-(2-methoxyethoxymethyl)-3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-a]phthalazine</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>Diazanaphthalenes</klass> <subklass>Benzodiazines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0272433</sync-id> <structure-inchikey>YSKCSMCLWKOPTC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000008800000000000000000001000000000000000000000000000000000000000200000000000002080000008000000000000000002200000000000000000000000000000000000800000004000000100000200000040000000040000000000010040000000000004802000000100000000000000000400000000000040000000800000000000000000880000000100000000000000000000000000000000000000040000080000010000000000000000000000000800000080000000040000000000000000004020000000008000002000000200000000000000000000000000000040000040040000000000080000000080000000000000</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���h��� �����h���h�� h���h�B������� ���� ��������� �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:26:28Z</structure-indexed-at> </compound>