O=C(CN(Cc1cc(F)cc(F)c1)C(=O)c1cnn([C@H]2CC[C@H](C(=O)NO)CC2)c1C(F)(F)F)c1c(Cl)cncc1Cl
SMILES: O=C(CN(Cc1cc(F)cc(F)c1)C(=O)c1cnn([C@H]2CC[C@H](C(=O)NO)CC2)c1C(F)(F)F)c1c(Cl)cncc1Cl

Molecular Processing

Molecular formula
C26H22Cl2F5N5O4
Molecular weight
634.39
Exact mass
633.0969
XLogP
5.64
TPSA
117.42
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
42
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
16
Covalent units
1
Fraction Csp3
0.346
Molar refractivity
137.84

Supplementary Information

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