Nombre: 6-(3-methoxy-5-phenylmethoxyphenyl)-7H-[1,3]dioxolo[4,5-g]quinolin-8-one
SMILES:
COC1=CC(=CC(=C1)C2=NC3=CC4=C(C=C3C(=O)C2)OCO4)OCC5=CC=CC=C5Molecular Processing
Molecular formula
C24H19NO5
Molecular weight
401.42
Exact mass
401.1263
XLogP
4.71
TPSA
66.35
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
30
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
111.48
Supplementary Information
InChIKey: NDORYXVVJMDFDI-UHFFFAOYSA-N
Sinónimos
SCHEMBL340392NDORYXVVJMDFDI-UHFFFAOYSA-N2-(3-Benzyloxy-5-methoxyphenyl)-6,7-methylenedioxyquinolin-4-one
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