SMILES:
CC(C)(C)OC(=O)N1CCC(c2ccsc2CO)CC1Molecular Processing
Molecular formula
C15H23NO3S
Molecular weight
297.42
Exact mass
297.1399
XLogP
3.35
TPSA
49.77
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
80.02
Supplementary Information
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