CHEBI:109676 - 2-(1-adamantyl)-4-chloro-5-[(4-fluorophenyl)methylamino]-3-pyridazinone

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ChEBI Name 2-(1-adamantyl)-4-chloro-5-[(4-fluorophenyl)methylamino]-3-pyridazinone ChEBI ID CHEBI:109676 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C21H23ClFN3O Net Charge 0 Average Mass 387.879 Monoisotopic Mass 387.15137 InChI InChI=1S/C21H23ClFN3O/c22-19-18(24-11-13-1-3-17(23)4-2-13)12-25-26(20(19)27)21-8-14-5-15(9-21)7-16(6-14)10-21/h1-4,12,14-16,24H,5-11H2 InChIKey ANRSIGUDHUBZOA-UHFFFAOYSA-N SMILES C1C2CC3(CC1CC(C3)C2)N4C(=O)C(=C(C=N4)NCC5=CC=C(C=C5)F)Cl Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) View more via ChEBI Ontology ChEBI Ontology Outgoing 2-(1-adamantyl)-4-chloro-5-[(4-fluorophenyl)methylamino]-3-pyridazinone (CHEBI:109676) is a aromatic amine (CHEBI:33860) Manual Xref Database LSM-21104 LINCS View more database links