이름: ethyl 6-(6-(4-fluorophenyl)imidazo[2,1-b]oxazol-5-yl)-[1,2,4]triazolo[4,3-a]pyridine-3-carboxylate
SMILES:
CCOC(=O)c1nnc2ccc(-c3c(-c4ccc(F)cc4)nc4occn34)cn12Molecular Processing
Molecular formula
C20H14FN5O3
Molecular weight
391.36
Exact mass
391.1081
XLogP
3.62
TPSA
86.93
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
29
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
100.79
Supplementary Information
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