Nombre: N-{4-[(2-{[2-fluoro-5-(trifluoromethyl)phenyl]amino}-1-methyl-1H-benzimidazol-5-yl)oxy]pyridin-2-yl}-2-[4-(2-methoxyethyl)piperazin-1-yl]acetamide
SMILES:
COCCN1CCN(CC(=O)Nc2cc(Oc3ccc4c(c3)nc(Nc3cc(C(F)(F)F)ccc3F)n4C)ccn2)CC1Molecular Processing
Molecular formula
C29H31F4N7O3
Molecular weight
601.6
Exact mass
601.2425
XLogP
4.86
TPSA
96.78
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
43
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.345
Molar refractivity
153.1
Supplementary Information
Obteniendo detalles…
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