SMILES:
CCCN(CC)C[C@H]1COc2c(Cl)cc(S(C)(=O)=O)cc2O1Molecular Processing
Molecular formula
C15H22ClNO4S
Molecular weight
347.86
Exact mass
347.0958
XLogP
2.62
TPSA
55.84
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
86.88
Supplementary Information
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