EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:43142 - N-{5-[(7-{[(2S)-2-hydroxy-3-piperidin-1-ylpropyl]oxy}-6-methoxyquinazolin-4-yl)amino]pyrimidin-2-yl}benzamide

ChEBI IDCHEBI:43142
ChEBI NameN-{5-[(7-{[(2S)-2-hydroxy-3-piperidin-1-ylpropyl]oxy}-6-methoxyquinazolin-4-yl)amino]pyrimidin-2-yl}benzamide
Stars
ASCII NameN-{5-[(7-{[(2S)-2-hydroxy-3-piperidin-1-ylpropyl]oxy}-6-methoxyquinazolin-4-yl)amino]pyrimidin-2-yl}benzamide
Last Modified17 October 2009
DownloadsMolfile
FormulaC28H31N7O4
Net Charge0
Average Mass529.601
Monoisotopic Mass529.24375
SMILES[H]O[C@]([H])(C([H])([H])Oc1c(OC([H])([H])[H])c([H])c2c(N([H])c3c([H])nc(N([H])C(=O)c4c([H])c([H])c([H])c([H])c4[H])nc3[H])nc([H])nc2c1[H])C([H])([H])N1C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H]
InChIInChI=1S/C28H31N7O4/c1-38-24-12-22-23(13-25(24)39-17-21(36)16-35-10-6-3-7-11-35)31-18-32-26(22)33-20-14-29-28(30-15-20)34-27(37)19-8-4-2-5-9-19/h2,4-5,8-9,12-15,18,21,36H,3,6-7,10-11,16-17H2,1H3,(H,31,32,33)(H,29,30,34,37)/t21-/m0/s1
InChIKeyWHHFZOIADLFZRX-NRFANRHFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-{5-[(7-{[(2S)-2-hydroxy-3-piperidin-1-ylpropyl]oxy}-6-methoxyquinazolin-4-yl)amino]pyrimidin-2-yl}benzamide (CHEBI:43142) is a aminopyrimidine (CHEBI:38338)
N-{5-[(7-{[(2S)-2-hydroxy-3-piperidin-1-ylpropyl]oxy}-6-methoxyquinazolin-4-yl)amino]pyrimidin-2-yl}benzamide (CHEBI:43142) is a benzamides (CHEBI:22702)
N-{5-[(7-{[(2S)-2-hydroxy-3-piperidin-1-ylpropyl]oxy}-6-methoxyquinazolin-4-yl)amino]pyrimidin-2-yl}benzamide (CHEBI:43142) is a hydroxypiperidine (CHEBI:48590)
N-{5-[(7-{[(2S)-2-hydroxy-3-piperidin-1-ylpropyl]oxy}-6-methoxyquinazolin-4-yl)amino]pyrimidin-2-yl}benzamide (CHEBI:43142) is a quinazolines (CHEBI:38530)
Synonym  Source
N-{5-[(7-{[(2S)-2-hydroxy-3-piperidin-1-ylpropyl]oxy}-6-methoxyquinazolin-4-yl)amino]pyrimidin-2-yl}benzamidePDBeChem
Manual XrefsDatabases
HPMPDBeChem