SMILES:
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCN(c2ccc(F)cc2F)CC1Molecular Processing
Molecular formula
C21H22F2N4O4
Molecular weight
432.43
Exact mass
432.1609
XLogP
2.67
TPSA
79.16
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
31
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
110.6
Supplementary Information
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