CCOC(=O)c1cc(-c2ccc3c(c2)c2cc(-c4ccc(Cl)cc4Cl)c(=O)n(C)c2n3C)n[nH]1
SMILES: CCOC(=O)c1cc(-c2ccc3c(c2)c2cc(-c4ccc(Cl)cc4Cl)c(=O)n(C)c2n3C)n[nH]1

Molecular Processing

Molecular formula
C25H20Cl2N4O3
Molecular weight
495.37
Exact mass
494.0912
XLogP
5.57
TPSA
81.91
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
34
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
0.16
Molar refractivity
134.66

Supplementary Information

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