Nombre: (RS)-[5-dimethylamino-2-(3-oxo-3-{3-[4-(tetrahydro-pyran-2-yloxymethyl)-pyrazol-1-yl]-phenyl}-propionylamino)-4-trifluoromethyl-phenyl]-carbamic acid tert-butyl ester
SMILES:
CN(C)c1cc(NC(=O)OC(C)(C)C)c(NC(=O)CC(=O)c2cccc(-n3cc(COC4CCCCO4)cn3)c2)cc1C(F)(F)FMolecular Processing
Molecular formula
C32H38F3N5O6
Molecular weight
645.68
Exact mass
645.2774
XLogP
6.56
TPSA
124.02
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
46
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
165.15
Supplementary Information
Obteniendo detalles…
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