307464 <common-name>2-tert-butyl-1-quinolin-8-yl-3-(1,3-thiazol-2-yl)guanidine</common-name> <description>2-tert-butyl-1-quinolin-8-yl-3-(1,3-thiazol-2-yl)guanidine belongs to the quinolines and derivatives, a class of organoheterocyclic compounds within the organic compounds. It has the chemical formula C17H19N5S and an average molecular weight of 325.40 g/mol.</description> <cas>72041-94-2</cas> <pubchem-id>3055138</pubchem-id> <chemical-formula>C17H19N5S</chemical-formula> <weight>325.4</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">2026-08-29T01:36:05Z</created-at> <updated-at type="dateTime">2026-08-29T01:36:05Z</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=C(NC1=CC=CC2=C1N=CC=C2)NC3=NC=CS3</moldb-smiles> <moldb-formula>C17H19N5S</moldb-formula> <moldb-inchi>InChI=1S/C17H19N5S/c1-17(2,3)22-15(21-16-19-10-11-23-16)20-13-8-4-6-12-7-5-9-18-14(12)13/h4-11H,1-3H3,(H2,19,20,21,22)</moldb-inchi> <moldb-inchikey>BJKOOPOSOQHTAV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">325.1361168</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.2</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>CHEM303357</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>2-tert-butyl-1-quinolin-8-yl-3-(1,3-thiazol-2-yl)guanidine</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>Quinolines and derivatives</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0258510</sync-id> <structure-inchikey>BJKOOPOSOQHTAV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000000000000000000000000200000000000000000000000000000000000000000000000100000001000010000204080000000000000c000000000000400000000000020001000001000000000000000000010000000000004000000000000000000010000000000000000000008000000000000000000000020000000000001100040000001800000000000000080800020000000000080000000000000000000000000000000000000080000000000000000080000000000000000000000000021000000000000000000080000000000008000000800000200000000000000008000400001002040000000000000401000000000000000000000000000</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�B������ ���� ���������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:15:38Z</structure-indexed-at> </compound>