الاسم: [2-(2-[1,3]dioxolan-2-yl-phenyl)-6-methoxy-benzo[b]thiophen-3-yl]-[4-(2-piperidin-1-yl-ethoxy)-phenyl]-methanone
SMILES:
COc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(-c3ccccc3C3OCCO3)sc2c1Molecular Processing
Molecular formula
C32H33NO5S
Molecular weight
543.69
Exact mass
543.2079
XLogP
6.72
TPSA
57.23
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
39
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.344
Molar refractivity
154.12
Supplementary Information
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