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CHEBI:125071 - 1-[(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-2-pyridin-4-ylethanone

ChEBI IDCHEBI:125071
ChEBI Name1-[(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-2-pyridin-4-ylethanone
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DownloadsMolfile
FormulaC25H25N3O2
Net Charge0
Average Mass399.494
Monoisotopic Mass399.19468
SMILESCOc1cccc(-c2ccc(C3[C@@H]4CN(C(=O)Cc5ccncc5)C[C@H]3N4)cc2)c1
InChIInChI=1S/C25H25N3O2/c1-30-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22-15-28(16-23(25)27-22)24(29)13-17-9-11-26-12-10-17/h2-12,14,22-23,25,27H,13,15-16H2,1H3/t22-,23+,25?
InChIKeyHNVPMDBINPMNDO-HCGNOCCLSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-2-pyridin-4-ylethanone (CHEBI:125071) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
LSM-36533LINCS