C=CCOC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)N(S(C)(=O)=O)C1c1ccc(C#N)cc1S(C)(=O)=O
SMILES: C=CCOC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)N(S(C)(=O)=O)C1c1ccc(C#N)cc1S(C)(=O)=O

Molecular Processing

Molecular formula
C25H22F3N3O7S2
Molecular weight
597.59
Exact mass
597.0851
XLogP
3.93
TPSA
141.92
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
40
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.24
Molar refractivity
136.87

Supplementary Information

Obteniendo detalles…

Participa en 2 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→