COc1ccccc1CNc1nc(-c2ccc(Oc3ccccc3)cc2)cnc1N
SMILES: COc1ccccc1CNc1nc(-c2ccc(Oc3ccccc3)cc2)cnc1N

Molecular Processing

Molecular formula
C24H22N4O2
Molecular weight
398.47
Exact mass
398.1743
XLogP
5.14
TPSA
82.29
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
118.72

Supplementary Information

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