Name: 5-[4-(pyrrolidine-1-sulfonyl)-benzyloxy]-4′-trifluoromethyl-biphenyl-3-yl-acetic acid
SMILES:
O=C(O)Cc1cc(OCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc(-c2ccc(C(F)(F)F)cc2)c1Molecular Processing
Molecular formula
C26H24F3NO5S
Molecular weight
519.54
Exact mass
519.1327
XLogP
5.36
TPSA
83.91
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
36
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.269
Molar refractivity
126.99
Supplementary Information
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