Cc1ccc(F)cc1C1NC(=O)CC(c2cc(Cl)ccc2N2CCNCC2)C12C(=O)Nc1cc(Cl)ccc12
SMILES: Cc1ccc(F)cc1C1NC(=O)CC(c2cc(Cl)ccc2N2CCNCC2)C12C(=O)Nc1cc(Cl)ccc12

Molecular Processing

Molecular formula
C29H27Cl2FN4O2
Molecular weight
553.47
Exact mass
552.1495
XLogP
5.09
TPSA
73.47
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
38
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.31
Molar refractivity
147.67

Supplementary Information

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