SMILES:
O=C(NCCc1ccccn1)c1ccc(CNc2c(Cl)ccc3c2CCN(C(=O)C(F)(F)F)CC3)cc1Molecular Processing
Molecular formula
C27H26ClF3N4O2
Molecular weight
530.98
Exact mass
530.1696
XLogP
4.81
TPSA
74.33
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.296
Molar refractivity
135.54
Supplementary Information
Obteniendo detalles…
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