Nombre: N-benzyl-2-chloro-N-methyl-6-((2,2,2-trifluoroethoxy)methyl)pyrimidin-4-amine
SMILES:
CN(Cc1ccccc1)c1cc(COCC(F)(F)F)nc(Cl)n1Molecular Processing
Molecular formula
C15H15ClF3N3O
Molecular weight
345.75
Exact mass
345.0856
XLogP
3.85
TPSA
38.25
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
81.3
Supplementary Information
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