الاسم: tert-Butyl 4-[1-(2-fluorophenyl)-1H-[1,2,3]triazol-4-yl]-1,2,3,6-tetrahydropyridine-1-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CC=C(c2cn(-c3ccccc3F)nn2)CC1Molecular Processing
Molecular formula
C18H21FN4O2
Molecular weight
344.39
Exact mass
344.1649
XLogP
3.43
TPSA
60.25
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.389
Molar refractivity
91.72
Supplementary Information
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