CS(=O)(=O)N1CCN(c2ccc(Br)cc2)CC1
名称: 1-(methylsulfonyl)-4-(4-bromophenyl)piperazine
SMILES: CS(=O)(=O)N1CCN(c2ccc(Br)cc2)CC1

Molecular Processing

Molecular formula
C11H15BrN2O2S
Molecular weight
319.22
Exact mass
318.0038
XLogP
1.53
TPSA
40.62
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
72.77

Supplementary Information

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