CCCO[C@H]1CC[C@H](N2CCC(n3c(=O)oc4cc(C)c(S(C)(=O)=O)cc43)CC2)CC1.Cl
SMILES: CCCO[C@H]1CC[C@H](N2CCC(n3c(=O)oc4cc(C)c(S(C)(=O)=O)cc43)CC2)CC1.Cl

Molecular Processing

Molecular formula
C23H35ClN2O5S
Molecular weight
487.06
Exact mass
486.1955
XLogP
4.1
TPSA
81.75
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
32
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.696
Molar refractivity
127.7

Supplementary Information

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