CCc1c(N)ncnc1N1CCC(c2nc(-c3ccc(F)c(C(N)=O)c3)cn2CCN2CCC2)CC1
SMILES: CCc1c(N)ncnc1N1CCC(c2nc(-c3ccc(F)c(C(N)=O)c3)cn2CCN2CCC2)CC1

Molecular Processing

Molecular formula
C26H33FN8O
Molecular weight
492.6
Exact mass
492.2761
XLogP
2.81
TPSA
119.19
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
137.21

Supplementary Information

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