346690 <common-name>1-[(2-chlorophenyl)methyl-methylamino]-3-[3-(dimethylamino)propyl]-3-phenylindol-2-one</common-name> <description>1-[(2-chlorophenyl)methyl-methylamino]-3-[3-(dimethylamino)propyl]-3-phenylindol-2-one is a compound with the formula C27H30ClN3O. It has an average molecular weight of 448.00 g/mol.</description> <cas nil="true"/> <pubchem-id>36514</pubchem-id> <chemical-formula>C27H30ClN3O</chemical-formula> <weight>448</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">2026-08-31T10:12:23Z</created-at> <updated-at type="dateTime">2026-08-31T10:12:23Z</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>CN(C)CCCC1(C2=CC=CC=C2N(C1=O)N(C)CC3=CC=CC=C3Cl)C4=CC=CC=C4</moldb-smiles> <moldb-formula>C27H30ClN3O</moldb-formula> <moldb-inchi>InChI=1S/C27H30ClN3O/c1-29(2)19-11-18-27(22-13-5-4-6-14-22)23-15-8-10-17-25(23)31(26(27)32)30(3)20-21-12-7-9-16-24(21)28/h4-10,12-17H,11,18-20H2,1-3H3</moldb-inchi> <moldb-inchikey>VFIRCPLYLNAYJS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">447.2077403</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.6</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>CHEM342583</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-[(2-chlorophenyl)methyl-methylamino]-3-[3-(dimethylamino)propyl]-3-phenylindol-2-one</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>Phenylbutylamines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0297042</sync-id> <structure-inchikey>VFIRCPLYLNAYJS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000200000001000000000000000000001000010000000001000020000000400002000004000000000000000000000000000410000000000008400000000000000000000028000020000400000000000000000008000010000000000000000000084000000000000100200000020000000000000000000048000000802000000000000000140000000100000000800000002400000100000000000004000000080000000000000000000800000008000000000000000000000000040000000000010000000010000000000000000200000000000000080000000000000040000000010000000001000000080000000000000000</structure-fingerprint> 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