名称: 2-methyl-2-(2-methyl-furan-3-sulfonyl)-3-[4-(2-piperidin-1-yl-ethoxy)-phenyl]-propionic acid ethyl ester
SMILES:
CCOC(=O)C(C)(Cc1ccc(OCCN2CCCCC2)cc1)S(=O)(=O)c1ccoc1CMolecular Processing
Molecular formula
C24H33NO6S
Molecular weight
463.6
Exact mass
463.2029
XLogP
3.79
TPSA
86.05
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
10
Heavy atoms
32
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.542
Molar refractivity
121.6
Supplementary Information
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