SMILES:
OC(c1ccccc1)(c1ccccc1)C12CC[N+](CCc3ccccc3)(CC1)CC2Molecular Processing
Molecular formula
C28H32NO+
Molecular weight
398.57
Exact mass
398.2478
XLogP
5.17
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
30
Rings
6
Aromatic rings
3
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
1
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
122.04
Supplementary Information
Obteniendo detalles…
Participa en 1 reacciones→