SMILES:
O=C(c1cccnc1Oc1cc(Cl)ccc1Cl)N1CCN(C2CC2)c2ccccc21Molecular Processing
Molecular formula
C23H19Cl2N3O2
Molecular weight
440.33
Exact mass
439.0854
XLogP
5.81
TPSA
45.67
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
30
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
119.26
Supplementary Information
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