SMILES:
Cn1ncc(C=CC(=O)Nc2ccc(SC(=O)OCc3ccccc3)cc2)c1-c1ccc(F)cc1Molecular Processing
Molecular formula
C27H22FN3O3S
Molecular weight
487.56
Exact mass
487.1366
XLogP
6.31
TPSA
73.22
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.074
Molar refractivity
135.19
Supplementary Information
Obteniendo detalles…
Participa en 1 reacciones→