Sevasemten
2-[(5-fluoro-3-pyridinyl)methyl]-6-[2-(2,2,2-trifluoroethoxy)pyrimidin-5-yl]pyridazin-3-one
Molecular Identity
Sevasemten
2-[(5-fluoro-3-pyridinyl)methyl]-6-[2-(2,2,2-trifluoroethoxy)pyrimidin-5-yl]pyridazin-3-one
PubChem CID: 149205919
2D Structure
Properties
C16H11F4N5O2
Molecular Formula
381.28
Molecular Weight
g/mol
381.0849
Exact Mass
Da
1.7
XLogP
Drug-like (Lipinski: < 5)
80.6
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
10
H-Bond Acceptors
590
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=O)N(N=C1C2=CN=C(N=C2)OCC(F)(F)F)CC3=CC(=CN=C3)FIsomeric SMILES
SMILES: C1=CC(=O)N(N=C1C2=CN=C(N=C2)OCC(F)(F)F)CC3=CC(=CN=C3)FSynonyms(20)
Sevasemten2417395-15-2EDG-5506JT5OYR0WUKEDG-005506RefChem:10984932-[(5-Fluoropyridin-3-yl)methyl]-6-[2-(2,2,2-trifluoroethoxy)pyrimidin-5-yl]pyridazin-3-onesevasemten [INN]Sevasemten [WHO-DD]Sevasemten (USAN/INN)SEVASEMTEN [USAN]CHEMBL5314486SCHEMBL23528413GTPL13704EDG5506
Data from PubChem (NCBI)
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