SMILES:
CN1CC(=O)CCn2c(c3c(c(O)c2=O)C(=O)N(Cc2ccc(F)c(Cl)c2)CC3)C1=OMolecular Processing
Molecular formula
C21H19ClFN3O5
Molecular weight
447.85
Exact mass
447.0997
XLogP
1.59
TPSA
99.92
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
31
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
108.81
Supplementary Information
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