SMILES:
CCOC(=O)c1cc(-c2ccc3c(c2)c2cc(-c4ccc(Cl)cc4Cl)c(=O)n(C)c2n3C)nn1CMolecular Processing
Molecular formula
C26H22Cl2N4O3
Molecular weight
509.39
Exact mass
508.1069
XLogP
5.58
TPSA
71.05
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
35
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
139.28
Supplementary Information
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