351298 <common-name>N-[(3-methylphenyl)carbamothioyl]-2-(4-oxo-2-phenylquinazolin-3-yl)-3-phenylpropanamide</common-name> <description>N-[(3-methylphenyl)carbamothioyl]-2-(4-oxo-2-phenylquinazolin-3-yl)-3-phenylpropanamide is a chemical compound with the formula C31H26N4O2S. With an average molecular weight of 518.60 g/mol, N-[(3-methylphenyl)carbamothioyl]-2-(4-oxo-2-phenylquinazolin-3-yl)-3-phenylpropanamide is a heavy molecule.</description> <cas>72045-82-0</cas> <pubchem-id>3055182</pubchem-id> <chemical-formula>C31H26N4O2S</chemical-formula> <weight>518.6</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">2026-08-31T16:55:28Z</created-at> <updated-at type="dateTime">2026-08-31T16:55:28Z</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=CC(=CC=C1)NC(=S)NC(=O)C(CC2=CC=CC=C2)N3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5</moldb-smiles> <moldb-formula>C31H26N4O2S</moldb-formula> <moldb-inchi>InChI=1S/C31H26N4O2S/c1-21-11-10-16-24(19-21)32-31(38)34-29(36)27(20-22-12-4-2-5-13-22)35-28(23-14-6-3-7-15-23)33-26-18-9-8-17-25(26)30(35)37/h2-19,27H,20H2,1H3,(H2,32,34,36,38)</moldb-inchi> <moldb-inchikey>XEPRINQASKDPLW-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">518.1776473</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.6</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>CHEM347191</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>N-[(3-methylphenyl)carbamothioyl]-2-(4-oxo-2-phenylquinazolin-3-yl)-3-phenylpropanamide</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>N-phenylthioureas</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0301598</sync-id> <structure-inchikey>XEPRINQASKDPLW-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400000000000000000018000401200010000000000000081000000000000000000000000400000200000000000000020040000000000000000000000002000800000000000000004000000000000000000200000000000010000000080008000000001000100080000000042001000000000000001000000000000000000040000010001402000008040000100000000808000000001000000000000000000000010000000000000000400000800000000000008000000200000000008000000000000200400000000000000000000000000000000000020000002a0000000000000008100000001004040000000000400000000008000000000000000000100</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�������@h�������@h�������@(������@(�������(������@(������@h�������@h�������@h�������@h�������@h������������h���h���h���h���h��� �� � (�� � ��(�� � �������h���h���h���h���h� ����h���h���h���h���h���h���h���h���h���(�� !h�!"h�"#h�#$h�$%h���h���h���h���h�% h�B���������������������������������!"#$% ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:49:14Z</structure-indexed-at> </compound>