SMILES:
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCN(c2ccc(OC(F)(F)F)cc2)CC1Molecular Processing
Molecular formula
C22H23F3N4O5
Molecular weight
480.44
Exact mass
480.1621
XLogP
3.29
TPSA
88.39
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
117.37
Supplementary Information
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