COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl
Name: compound 7h
SMILES: COc1cccc(-c2cn(Cc3c(F)cccc3C(F)(F)F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)c1Cl

Molecular Processing

Molecular formula
C27H22ClF4N3O3
Molecular weight
547.94
Exact mass
547.1286
XLogP
5.25
TPSA
79.25
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
38
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.185
Molar refractivity
135.83

Supplementary Information

Fetching details…

Involved in 9 reactions→

Extended Search

Substructure Search→Similarity Search→