CC(=NNC(N)=O)c1ccc2ncc(C(C)(O)c3cc4cccnc4cc3F)n2n1
SMILES: CC(=NNC(N)=O)c1ccc2ncc(C(C)(O)c3cc4cccnc4cc3F)n2n1

Molecular Processing

Molecular formula
C20H18FN7O2
Molecular weight
407.41
Exact mass
407.1506
XLogP
2.06
TPSA
130.79
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.15
Molar refractivity
108.29

Supplementary Information

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