357816 <common-name>Hexadecyl 1-[4-(diethylamino)-2-ethoxyphenyl]-1-(1-ethyl-2-methylindol-3-yl)-3-oxo-2-benzofuran-5-carboxylate</common-name> <description>Hexadecyl 1-[4-(diethylamino)-2-ethoxyphenyl]-1-(1-ethyl-2-methylindol-3-yl)-3-oxo-2-benzofuran-5-carboxylate has the chemical formula C48H66N2O5. With an average molecular weight of 751.00 g/mol, Hexadecyl 1-[4-(diethylamino)-2-ethoxyphenyl]-1-(1-ethyl-2-methylindol-3-yl)-3-oxo-2-benzofuran-5-carboxylate is a heavy molecule.</description> <cas>69898-62-0</cas> <pubchem-id>112175</pubchem-id> <chemical-formula>C48H66N2O5</chemical-formula> <weight>751</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">2026-09-01T05:07:40Z</created-at> <updated-at type="dateTime">2026-09-01T05:07:40Z</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>CCCCCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(OC2=O)(C3=C(C=C(C=C3)N(CC)CC)OCC)C4=C(N(C5=CC=CC=C54)CC)C</moldb-smiles> <moldb-formula>C48H66N2O5</moldb-formula> <moldb-inchi>InChI=1S/C48H66N2O5/c1-7-12-13-14-15-16-17-18-19-20-21-22-23-26-33-54-46(51)37-29-31-41-40(34-37)47(52)55-48(41,45-36(6)50(10-4)43-28-25-24-27-39(43)45)42-32-30-38(49(8-2)9-3)35-44(42)53-11-5/h24-25,27-32,34-35H,7-23,26,33H2,1-6H3</moldb-inchi> <moldb-inchikey>FUFPPSDQHUWJRG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">750.4971732</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>14.1</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>CHEM353709</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>Hexadecyl 1-[4-(diethylamino)-2-ethoxyphenyl]-1-(1-ethyl-2-methylindol-3-yl)-3-oxo-2-benzofuran-5-carboxylate</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>Benzene and substituted derivatives</klass> <subklass>Benzoic acids and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0308064</sync-id> <structure-inchikey>FUFPPSDQHUWJRG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40020200400000008880000000000000050000400080000000000000400000000000002000020000000008000000000000004004000000000040000000080000000000000000000010000000000000020800000000100000000040000000000040020210200000000200000104000000000000980000088000000000000000001000048000000808000000000010000000000000100000000030040000000260000000000000000040000084000000000000008080000000020000000200000000000040000800000000000002000000001004000002002000200020000000000000000000000000050000000010400800000000020080000000000000001</structure-fingerprint> 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������(�������(�������(������@(������@(������@h�������@(������@h�������@h��������(�������`�������`�������`�������`�������(�������`�������`������@(������@(������@(������@(������@h�������@h�������@h�������@h�������@(�������`�������`�������`������������������������������� � � ������ � ���������� ��(��� ��h���h���h���h���h��������� ��(������h���h�� h� !h�!"h� # #$�$%�#&�&'��( ()�)*��+�+,h�,-h�-.h�./h�/0h�01h�12h�23h�-4�45�,6���h��� "�h�3+h�3.h�B�������������������� !"��,+3.-�/0123.����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:55:32Z</structure-indexed-at> </compound>