SMILES:
CC(=O)NN1C(CNC(=O)CCl)=Nc2ccc(Cl)cc2C1(O)c1ccccc1ClMolecular Processing
Molecular formula
C19H17Cl3N4O3
Molecular weight
455.73
Exact mass
454.0366
XLogP
2.94
TPSA
94.03
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
112.38
Supplementary Information
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