O=C(Nc1ccccc1)c1ccc(B(O)O)cc1
Name: 4-(anilinocarbonyl)phenylboronic acid
SMILES: O=C(Nc1ccccc1)c1ccc(B(O)O)cc1

Molecular Processing

Molecular formula
C13H12BNO3
Molecular weight
241.06
Exact mass
241.091
XLogP
0.62
TPSA
69.56
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
70.66

Supplementary Information

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