CHEBI:94998 - SCH-79797

ChEBI IDCHEBI:94998
ChEBI NameSCH-79797
Stars
DefinitionA member of the class of pyrroloquinazolines that is 7H-pyrrolo[3,2-f]quinazoline substituted by amino, cyclopropylamino, and 4-(propan-2-yl)benzyl groups at positions 1, 3 and 7, respectively. It is a PAR1 antagonist.
Last Modified8 July 2024
DownloadsMolfile
FormulaC23H25N5
Net Charge0
Average Mass371.488
Monoisotopic Mass371.21100
SMILESCC(C)c1ccc(Cn2ccc3c4c(N)nc(NC5CC5)nc4ccc32)cc1
InChIInChI=1S/C23H25N5/c1-14(2)16-5-3-15(4-6-16)13-28-12-11-18-20(28)10-9-19-21(18)22(24)27-23(26-19)25-17-7-8-17/h3-6,9-12,14,17H,7-8,13H2,1-2H3,(H3,24,25,26,27)
InChIKeyAVXQPEKZIGPIJW-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
protease-activated receptor-1 antagonist  An antagonist at the protease-activated receptor-1.
Application:
cardioprotective agent  Any protective agent that is able to prevent damage to the heart.
ChEBI Ontology
Outgoing Relation(s)
SCH-79797 (CHEBI:94998) has role antibacterial agent (CHEBI:33282)
SCH-79797 (CHEBI:94998) has role apoptosis inducer (CHEBI:68495)
SCH-79797 (CHEBI:94998) has role cardioprotective agent (CHEBI:77307)
SCH-79797 (CHEBI:94998) has role protease-activated receptor-1 antagonist (CHEBI:83313)
SCH-79797 (CHEBI:94998) is a cyclopropanes (CHEBI:51454)
SCH-79797 (CHEBI:94998) is a pyrroloquinazoline (CHEBI:231697)
SCH-79797 (CHEBI:94998) is a secondary amino compound (CHEBI:50995)
SCH-79797 (CHEBI:94998) is a tertiary amino compound (CHEBI:50996)
IUPAC Name 
N3-cyclopropyl-7-[4-(propan-2-yl)benzyl]-7H-pyrrolo[3,2-f]quinazoline-1,3-diamine
Synonyms  Source
SCH 79797ChEBI
SCH79797ChEBI
Manual XrefsDatabases
LSM-6224LINCS
SCH-79797Wikipedia
Registry NumbersSources
CAS:245520-69-8ChEBI
Citations