الاسم: ethyl 3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylate
SMILES:
CCOC(=O)C1CCn2c(nnc2C(F)(F)F)C1Molecular Processing
Molecular formula
C10H12F3N3O2
Molecular weight
263.22
Exact mass
263.0882
XLogP
1.42
TPSA
57.01
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
53.47
Supplementary Information
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