이름: tert-butyl 2-(2-fluoro-5-methyl-4-(2-methylpyridin-4-yl)phenyl)acetate
SMILES:
Cc1cc(-c2cc(F)c(CC(=O)OC(C)(C)C)cc2C)ccn1Molecular Processing
Molecular formula
C19H22FNO2
Molecular weight
315.39
Exact mass
315.1635
XLogP
4.39
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
88.65
Supplementary Information
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