Name: 7-N-(tert-butoxycarbonyl)-2-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[1,5-α]pyrazine
SMILES:
CC(C)(C)OC(=O)N1CCn2nc(C(F)(F)F)nc2C1Molecular Processing
Molecular formula
C11H15F3N4O2
Molecular weight
292.26
Exact mass
292.1147
XLogP
2.05
TPSA
60.25
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.727
Molar refractivity
61.67
Supplementary Information
Details werden geladen…
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