SMILES:
Cc1ccc(C(=O)Nc2ccon2)cc1-c1cc2cnnc(-c3ccccc3Cl)c2n(C)c1=OMolecular Processing
Molecular formula
C25H18ClN5O3
Molecular weight
471.9
Exact mass
471.1098
XLogP
4.86
TPSA
102.91
H-bond donors
1
H-bond acceptors
6
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
0.08
Molar refractivity
129.85
Supplementary Information
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