SMILES:
COc1cc2nc(-c3cccc(-c4ccccc4)c3)nc(Nc3ccc4[nH]ncc4c3)c2cc1OCCN1CCOCC1Molecular Processing
Molecular formula
C34H32N6O3
Molecular weight
572.67
Exact mass
572.2536
XLogP
6.3
TPSA
97.42
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
43
Rings
7
Aromatic rings
6
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.206
Molar refractivity
169.09
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→