COc1ccc(C(=O)O)c(NC(=O)c2ccc(F)cc2)c1C
Name: 2-(4-Fluoro-benzoylamino)-4-methoxy-3-methyl-benzoic acid
SMILES: COc1ccc(C(=O)O)c(NC(=O)c2ccc(F)cc2)c1C

Molecular Processing

Molecular formula
C16H14FNO4
Molecular weight
303.29
Exact mass
303.0907
XLogP
3.09
TPSA
75.63
H-bond donors
2
H-bond acceptors
3
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
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
79.04

Supplementary Information

Details werden geladen…

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