Nombre: {5-[[2-(4-Chloro-phenoxy)-ethyl]-(4-fluoro-benzenesulfonyl)-amino]-2-propyl-benzoimidazol-1-yl}-acetic acid tert-butyl ester
SMILES:
CCCc1nc2cc(N(CCOc3ccc(Cl)cc3)S(=O)(=O)c3ccc(F)cc3)ccc2n1CC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C30H33ClFN3O5S
Molecular weight
602.13
Exact mass
601.1813
XLogP
6.4
TPSA
90.73
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
41
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
157.45
Supplementary Information
Obteniendo detalles…
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