Name: (R)-4-(1-(2-aminopropyl)-1H-pyrazol-3-yl)-2-(trifluoromethyl)benzonitrile
SMILES:
C[C@@H](N)Cn1ccc(-c2ccc(C#N)c(C(F)(F)F)c2)n1Molecular Processing
Molecular formula
C14H13F3N4
Molecular weight
294.28
Exact mass
294.1092
XLogP
2.79
TPSA
67.63
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
71.03
Supplementary Information
Details werden geladen…
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