SMILES:
Cc1nc(N2CCC(Cc3ccc(OC(F)(F)F)cc3)C2=O)sc1C(=O)NCc1cccnc1Molecular Processing
Molecular formula
C23H21F3N4O3S
Molecular weight
490.51
Exact mass
490.1286
XLogP
4.27
TPSA
84.42
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
119.55
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→