Name: 2-[5-fluoro-3-(trifluoromethyl)phenyl]-4-(3-iodopropyl)-1,3-oxazole
SMILES:
Fc1cc(-c2nc(CCCI)co2)cc(C(F)(F)F)c1Molecular Processing
Molecular formula
C13H10F4INO
Molecular weight
399.13
Exact mass
398.9743
XLogP
4.87
TPSA
26.03
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
74.11
Supplementary Information
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