CC(=O)CNCC(CN(C)C(=O)C1(c2ccc(-c3ccc(Cl)c(Cl)c3)c(F)c2)CC1)OC(C)=O
SMILES: CC(=O)CNCC(CN(C)C(=O)C1(c2ccc(-c3ccc(Cl)c(Cl)c3)c(F)c2)CC1)OC(C)=O

Molecular Processing

Molecular formula
C25H27Cl2FN2O4
Molecular weight
509.41
Exact mass
508.1332
XLogP
4.4
TPSA
75.71
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
34
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
129.51

Supplementary Information

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