Nombre: 2-(2-thiomorpholin-4-ylethyl)isoindol-1,3-dione
SMILES:
O=C1c2ccccc2C(=O)N1CCN1CCSCC1Molecular Processing
Molecular formula
C14H16N2O2S
Molecular weight
276.36
Exact mass
276.0932
XLogP
1.33
TPSA
40.62
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
75.57
Supplementary Information
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