345898 <common-name>9-bromo-5-(4-methylphenyl)-2-naphthalen-2-yl-5,10b-dihydro-1h-pyrazolo[1,5-c][1,3]benzoxazine</common-name> <description>9-bromo-5-(4-methylphenyl)-2-naphthalen-2-yl-5,10b-dihydro-1h-pyrazolo[1,5-c][1,3]benzoxazine is a chemical compound with the formula C27H21BrN2O. It has an average molecular weight of 469.40 g/mol.</description> <cas nil="true"/> <pubchem-id>3308652</pubchem-id> <chemical-formula>C27H21BrN2O</chemical-formula> <weight>469.4</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">2026-08-31T08:57:34Z</created-at> <updated-at type="dateTime">2026-08-31T08:57:34Z</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=C(C=C1)C2N3C(CC(=N3)C4=CC5=CC=CC=C5C=C4)C6=C(O2)C=CC(=C6)Br</moldb-smiles> <moldb-formula>C27H21BrN2O</moldb-formula> <moldb-inchi>InChI=1S/C27H21BrN2O/c1-17-6-8-19(9-7-17)27-30-25(23-15-22(28)12-13-26(23)31-27)16-24(29-30)21-11-10-18-4-2-3-5-20(18)14-21/h2-15,25,27H,16H2,1H3</moldb-inchi> <moldb-inchikey>LCDVGRZTSHBTNO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">468.08373</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>7.1</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>CHEM341791</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>9-bromo-5-(4-methylphenyl)-2-naphthalen-2-yl-5,10b-dihydro-1h-pyrazolo[1,5-c][1,3]benzoxazine</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>Organoheterocyclic compounds</superklass> <klass>Benzoxazines</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0296252</sync-id> <structure-inchikey>LCDVGRZTSHBTNO-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000001800000110000000000000000000002000000000000020000000000000000c0000000000000200000080000000000000000200000000000000800000000000000000800102000200000000000000000000000000110000800400020100008000000001000000101112000040000001800000000000000004800000000100000000000000000001000000008000000000000000080000000000008000000000000000000000001000000000000000000000000100000080000000000000002000000200000000000010000100000001000040000008400080000000400000000000000000000000</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�B������������ ��������� ����������� �������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:44:48Z</structure-indexed-at> </compound>