CN([C@H]1CC[C@H](OCCCCCCBr)CC1)S(=O)(=O)c1ccc(Br)cc1
SMILES: CN([C@H]1CC[C@H](OCCCCCCBr)CC1)S(=O)(=O)c1ccc(Br)cc1

Molecular Processing

Molecular formula
C19H29Br2NO3S
Molecular weight
511.32
Exact mass
509.0235
XLogP
5.35
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
10
Heavy atoms
26
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.684
Molar refractivity
113.35

Supplementary Information

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