10548 <common-name>1,2-Dibenzoyl-1-tert-butylhydrazine</common-name> <description nil="true"/> <cas>112225-87-3</cas> <pubchem-id>86307</pubchem-id> <chemical-formula>C18H20N2O2</chemical-formula> <weight>296.4</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">2016-05-19T03:05:04Z</created-at> <updated-at type="dateTime">2026-08-20T00:26:12Z</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>CC(C)(C)N(N=C(O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1</moldb-smiles> <moldb-formula>C18H20N2O2</moldb-formula> <moldb-inchi>InChI=1S/C18H20N2O2/c1-18(2,3)20(17(22)15-12-8-5-9-13-15)19-16(21)14-10-6-4-7-11-14/h4-13H,1-3H3,(H,19,21)</moldb-inchi> <moldb-inchikey>NISLLQUWIJASOV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">296.37</moldb-average-mass> <moldb-mono-mass type="decimal">296.152477892</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.3</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>77850</chemspider-id> <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>CHEM009443</chemdb-id> <dsstox-id>DTXSID7073800</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00001495</susdat-id> <iupac>N'-benzoyl-N'-tert-butylbenzohydrazide</iupac> <moldb-polar-surface-area>52.9</moldb-polar-surface-area> <moldb-refractivity>87.89679999999998</moldb-refractivity> <moldb-polarizability>32.55297664772014</moldb-polarizability> <moldb-rotatable-bond-count>4</moldb-rotatable-bond-count> <moldb-acceptor-count>3</moldb-acceptor-count> <moldb-donor-count>1</moldb-donor-count> <moldb-pka-strongest-acidic>8.301479687006095</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>0.37012265812615086</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>2</moldb-number-of-rings> <moldb-alogps-logp>3.02</moldb-alogps-logp> <moldb-alogps-logs>-4.50</moldb-alogps-logs> <moldb-alogps-solubility>9.46e-03 g/l</moldb-alogps-solubility> <kingdom>Organic compounds</kingdom> <superklass>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Benzoic acids and derivatives</subklass> </compound>