Name: (R)—N-(1-(3-(aminomethyl)-4-fluorophenyl)-1-(3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl)-2-phenylethyl)-4-fluoro-3-(trifluoromethyl)benzamide hydrochloride
SMILES:
Cl.NCc1cc([C@@](Cc2ccccc2)(NC(=O)c2ccc(F)c(C(F)(F)F)c2)c2cc(F)cc(OC(F)(F)C(F)F)c2)ccc1FMolecular Processing
Molecular formula
C31H23ClF10N2O2
Molecular weight
680.97
Exact mass
680.1288
XLogP
8.16
TPSA
64.35
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
10
Heavy atoms
46
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
2
Fraction Csp3
0.194
Molar refractivity
149.31
Supplementary Information
Details werden geladen…
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