Name: Intermediate 120
SMILES:
CC(C)(C)OC(=O)N1CCN(CCCOS(C)(=O)=O)CC1Molecular Processing
Molecular formula
C13H26N2O5S
Molecular weight
322.43
Exact mass
322.1562
XLogP
0.91
TPSA
76.15
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
21
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.923
Molar refractivity
79.66
Supplementary Information
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