Name: (S)-6-chloro-N2-[1-(4-fluorophenyl)ethyl]-N4-(pyrazin-2-yl)pyrimidine-2,4-diamine
SMILES:
C[C@H](Nc1nc(Cl)cc(Nc2cnccn2)n1)c1ccc(F)cc1Molecular Processing
Molecular formula
C16H14ClFN6
Molecular weight
344.78
Exact mass
344.0953
XLogP
3.98
TPSA
75.62
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
90.79
Supplementary Information
Details werden geladen…
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