O=C(CN(Cc1cc(F)cc(F)c1)C(=O)c1cnn([C@H]2CC[C@H](C(=O)O)CC2)c1C(F)(F)F)c1cc[nH]n1
SMILES: O=C(CN(Cc1cc(F)cc(F)c1)C(=O)c1cnn([C@H]2CC[C@H](C(=O)O)CC2)c1C(F)(F)F)c1cc[nH]n1

Molecular Processing

Molecular formula
C24H22F5N5O4
Molecular weight
539.46
Exact mass
539.1592
XLogP
4.24
TPSA
121.18
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
119.88

Supplementary Information

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