CC(=O)C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2
CAS: 263257-18-7
Nombre: 1-[4-(quinolin-2-ylmethoxy)phenyl]ethanone
SMILES: CC(=O)C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2

Molecular Processing

Molecular formula
C18H15NO2
Molecular weight
277.32
Exact mass
277.1103
XLogP
4.02
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
82.52

Supplementary Information

InChIKey: RXLUBEHKLXRCRA-UHFFFAOYSA-N
Sinónimos
SCHEMBL3271764RXLUBEHKLXRCRA-UHFFFAOYSA-NAKOS009035161DB-1030541-[4-(Quinolin-2-ylmethoxy)-phenyl]-ethanone263257-18-7
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