Nombre: 6,2′-difluoro-5′-[3-(1-hydroxy-1-methylethyl)imidazo[1,2-b][1,2,4]triazin-7-yl]-4′-methoxybiphenyl-2-carbonitrile
SMILES:
COc1cc(F)c(-c2c(F)cccc2C#N)cc1-c1cnc2nc(C(C)(C)O)cnn12Molecular Processing
Molecular formula
C22H17F2N5O2
Molecular weight
421.41
Exact mass
421.135
XLogP
3.84
TPSA
96.33
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
108.08
Supplementary Information
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