SMILES:
CC1(C)OB(c2ccc3ccc(-c4ccccc4)nc3c2)OC1(C)CMolecular Processing
Molecular formula
C21H22BNO2
Molecular weight
331.22
Exact mass
331.1744
XLogP
4.2
TPSA
31.35
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
25
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
102.9
Supplementary Information
Details werden geladen…
An 61 Reaktionen beteiligt→