323495 <common-name>2-[[4-methyl-3-[(2-oxoazepane-1-carbonyl)amino]phenyl]carbamoyloxy]ethyl prop-2-enoate</common-name> <description>2-[[4-methyl-3-[(2-oxoazepane-1-carbonyl)amino]phenyl]carbamoyloxy]ethyl prop-2-enoate is a chemical compound with the formula C20H25N3O6. It has an average molecular weight of 403.40 g/mol.</description> <cas>84732-28-5</cas> <pubchem-id>158456</pubchem-id> <chemical-formula>C20H25N3O6</chemical-formula> <weight>403.4</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">2026-08-30T00:13:31Z</created-at> <updated-at type="dateTime">2026-08-30T00:13:31Z</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=C(C=C(C=C1)NC(=O)OCCOC(=O)C=C)NC(=O)N2CCCCCC2=O</moldb-smiles> <moldb-formula>C20H25N3O6</moldb-formula> <moldb-inchi>InChI=1S/C20H25N3O6/c1-3-18(25)28-11-12-29-20(27)21-15-9-8-14(2)16(13-15)22-19(26)23-10-6-4-5-7-17(23)24/h3,8-9,13H,1,4-7,10-12H2,2H3,(H,21,27)(H,22,26)</moldb-inchi> <moldb-inchikey>LXIZDQCVWXIOHJ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">403.1743355</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.1</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>CHEM319388</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>2-[[4-methyl-3-[(2-oxoazepane-1-carbonyl)amino]phenyl]carbamoyloxy]ethyl prop-2-enoate</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>Phenylcarbamic acid esters</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0274172</sync-id> <structure-inchikey>LXIZDQCVWXIOHJ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2004000000000000000080000000000000001000000000810000002000000000000000000000022020000000000080000000000000000000001000000000080000000004000000000000000000000000002020000000030000000000000000000000000201000000001000000010000000000002010000010000000000000000080000004000400000000000000000008000000200000001008000100000000000000000000200000000020008110000000000000000000000a00000000000000000000000000000000000004006000000000010000000200020020200000000002000800000000000004000000000040000000000000000000a800000000000</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��� B�����������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:27:53Z</structure-indexed-at> </compound>