COc1ccc(CC2CN(Cc3ccccc3)CCN2C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1
SMILES: COc1ccc(CC2CN(Cc3ccccc3)CCN2C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1

Molecular Processing

Molecular formula
C28H26F6N2O2
Molecular weight
536.52
Exact mass
536.1898
XLogP
6.3
TPSA
32.78
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.321
Molar refractivity
129.69

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt