CC(C)(C)OC(=O)N1CC2COCC(C1)N2c1nc(-c2ccc([N+](=O)[O-])cc2)nc2c1cnn2CC(F)(F)F
SMILES: CC(C)(C)OC(=O)N1CC2COCC(C1)N2c1nc(-c2ccc([N+](=O)[O-])cc2)nc2c1cnn2CC(F)(F)F

Molecular Processing

Molecular formula
C24H26F3N7O5
Molecular weight
549.51
Exact mass
549.1948
XLogP
3.79
TPSA
128.75
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
4
Heavy atoms
39
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
132.15

Supplementary Information

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