c1ccc(COc2ccn3cnnc3c2)cc1
Name: 7-(benzyloxy)-[1,2,4]triazolo[4,3-a]pyridine
SMILES: c1ccc(COc2ccn3cnnc3c2)cc1

Molecular Processing

Molecular formula
C13H11N3O
Molecular weight
225.25
Exact mass
225.0902
XLogP
2.31
TPSA
39.42
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
63.76

Supplementary Information

Details werden geladen…

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