SMILES:
CNC(=O)C1CC(SCc2ccc(OC)cc2)CN1CCOMolecular Processing
Molecular formula
C16H24N2O3S
Molecular weight
324.45
Exact mass
324.1508
XLogP
1.11
TPSA
61.8
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
89.21
Supplementary Information
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