이름: 2-fluoro-3-iodo-N-(3-isopropoxyphenyl)-4-methylbenzamide
SMILES:
Cc1ccc(C(=O)Nc2cccc(OC(C)C)c2)c(F)c1IMolecular Processing
Molecular formula
C17H17FINO2
Molecular weight
413.23
Exact mass
413.0288
XLogP
4.78
TPSA
38.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
94.01
Supplementary Information
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