SMILES:
COc1ccc2c(=O)n(C(C)C(N)=O)ccc2c1NC(=O)Cc1ccc(C(F)(F)F)cc1Molecular Processing
Molecular formula
C22H20F3N3O4
Molecular weight
447.41
Exact mass
447.1406
XLogP
3.26
TPSA
103.42
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.227
Molar refractivity
112.44
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→