Azetukalner
N-[4-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-2,6-dimethylphenyl]-3,3-dimethylbutanamide
Molecular Identity
Azetukalner
N-[4-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-2,6-dimethylphenyl]-3,3-dimethylbutanamide
PubChem CID: 24743936
2D Structure
Properties
C23H29FN2O
Molecular Formula
368.50
Molecular Weight
g/mol
368.2264
Exact Mass
Da
5.2
XLogP
Above Lipinski threshold
32.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
505
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CC(=CC(=C1NC(=O)CC(C)(C)C)C)N2CCC3=C(C2)C=CC(=C3)FIsomeric SMILES
SMILES: CC1=CC(=CC(=C1NC(=O)CC(C)(C)C)C)N2CCC3=C(C2)C=CC(=C3)FSynonyms(20)
EncukalnerAzetukalner1009344-33-5XEN110191WL7OD122XEN-1101n-[4-(6-fluoro-3,4-dihydro-1h-isoquinolin-2-yl)-2,6-dimethylphenyl]-3,3-dimethylbutanamideN-(4-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-2,6-dimethylphenyl)-3,3-dimethylbutanamideRefChem:136762KCNQ2/3 activator-1Encukalner [INN]azetukalner [INN]UNII-91WL7OD122N-(4-(6-fluoro-3,4-dihydroisoquinolin-2(1H)-yl)-2,6-dimethylphenyl)-3,3-dimethylbutanamideGLXC-26843
Data from PubChem (NCBI)
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