Irampanel
N,N-dimethyl-2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]ethanamine
Molecular Identity
Irampanel
N,N-dimethyl-2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]ethanamine
PubChem CID: 3038472
2D Structure
Properties
C18H19N3O2
Molecular Formula
309.40
Molecular Weight
g/mol
309.1477
Exact Mass
Da
3.5
XLogP
Drug-like (Lipinski: < 5)
51.4
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
5
H-Bond Acceptors
347
Complexity
SMILES
Canonical SMILES
SMILES: CN(C)CCOC1=CC=CC=C1C2=NC(=NO2)C3=CC=CC=C3Isomeric SMILES
SMILES: CN(C)CCOC1=CC=CC=C1C2=NC(=NO2)C3=CC=CC=C3Synonyms(20)
Irampanel206260-33-5BIIR 561BIIR-561R2GZD7LMYXBIIR-561 ClBIIR-561CLDTXSID301746475-(o-(2-(Dimethylamino)ethoxy)phenyl)-3-phenyl-1,2,4-oxadiazoleDimethyl-(2-(2-(3-phenyl-(1,2,4)oxadiazol-5-yl)phenoxy)ethyl)amine hydrochlorideirampanelumRefChem:148687DTXCID8097138Irampanel [INN]N,N-dimethyl-2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]ethanamine
Data from PubChem (NCBI)
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