SMILES:
CC(=O)NN1C(CNC(=O)OCc2ccccc2)=Nc2ccc(Cl)cc2C1(O)c1ccccc1ClMolecular Processing
Molecular formula
C25H22Cl2N4O4
Molecular weight
513.38
Exact mass
512.1018
XLogP
4.51
TPSA
103.26
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.16
Molar refractivity
133.28
Supplementary Information
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