339317 <common-name>1-[[4-[(5-amino-6-methyl-2-pyridinyl)amino]phenyl]methyl]-4-benzylpiperazine-2,3-dione</common-name> <description>1-[[4-[(5-amino-6-methyl-2-pyridinyl)amino]phenyl]methyl]-4-benzylpiperazine-2,3-dione is a chemical compound with the formula C24H25N5O2. It has an average molecular weight of 415.50 g/mol.</description> <cas>77917-42-1</cas> <pubchem-id>3060264</pubchem-id> <chemical-formula>C24H25N5O2</chemical-formula> <weight>415.5</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">2026-08-30T22:36:23Z</created-at> <updated-at type="dateTime">2026-08-30T22:36:23Z</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>CC1=C(C=CC(=N1)NC2=CC=C(C=C2)CN3CCN(C(=O)C3=O)CC4=CC=CC=C4)N</moldb-smiles> <moldb-formula>C24H25N5O2</moldb-formula> <moldb-inchi>InChI=1S/C24H25N5O2/c1-17-21(25)11-12-22(26-17)27-20-9-7-19(8-10-20)16-29-14-13-28(23(30)24(29)31)15-18-5-3-2-4-6-18/h2-12H,13-16,25H2,1H3,(H,26,27)</moldb-inchi> <moldb-inchikey>DRUDXKIZYJISHH-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">415.2008251</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.9</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>CHEM335210</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-[[4-[(5-amino-6-methyl-2-pyridinyl)amino]phenyl]methyl]-4-benzylpiperazine-2,3-dione</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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0289738</sync-id> <structure-inchikey>DRUDXKIZYJISHH-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000800800000000000000000000000100001000000000000000400001200220000000000000022004000000000000000000000000100000000000000000000000000000000000000020000000000000000000000000000000000000000000000010000000010000000200020100000001000000000000000000000040200000c01000000000000080001000000100000000000000000020000000000000000008000000080000000000000000004000008000000000080000000000000000000000000000000000000010000000002000000224040000000000000000000001000040000000000000000000000000000000000000100000</structure-fingerprint> 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