Name: 4-[(4-methyl-1-piperazinyl)sulfonyl]phenylboronic acid
SMILES:
CN1CCN(S(=O)(=O)c2ccc(B(O)O)cc2)CC1Molecular Processing
Molecular formula
C11H17BN2O4S
Molecular weight
284.15
Exact mass
284.1002
XLogP
-1.7
TPSA
81.08
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
72.52
Supplementary Information
Details werden geladen…
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