Nombre: ethyl 2-(2-amino-5-fluoroanilino)-6-methoxybenzo[b]thiophene-3-carboxylate
SMILES:
CCOC(=O)c1c(Nc2cc(F)ccc2N)sc2cc(OC)ccc12Molecular Processing
Molecular formula
C18H17FN2O3S
Molecular weight
360.41
Exact mass
360.0944
XLogP
4.55
TPSA
73.58
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
98.43
Supplementary Information
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