60XT58V8NZ
7-[[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]oxy]chromen-2-one
Molecular Identity
60XT58V8NZ
7-[[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]oxy]chromen-2-one
PubChem CID: 25058418
2D Structure
Properties
C16H17NO3
Molecular Formula
271.31
Molecular Weight
g/mol
271.1208
Exact Mass
Da
2.7
XLogP
Drug-like (Lipinski: < 5)
47.6
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
4
H-Bond Acceptors
410
Complexity
SMILES
Canonical SMILES
SMILES: C1CC2CC(CC1N2)OC3=CC4=C(C=C3)C=CC(=O)O4Isomeric SMILES
SMILES: C1C[C@H]2CC(C[C@@H]1N2)OC3=CC4=C(C=C3)C=CC(=O)O4Synonyms(9)
IP-2018IP201860XT58V8NZUNII-60XT58V8NZ881387-68-47-((3-exo)-8-Azabicyclo(3.2.1)oct-3-yloxy)-2H-1-benzopyran-2-one2H-1-Benzopyran-2-one, 7-((3-exo)-8-azabicyclo(3.2.1)oct-3-yloxy)-SCHEMBL1103728CHEMBL4650310
Data from PubChem (NCBI)
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Drug Network
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