COC(=O)C(C)Oc1cccc(C(C)Oc2cc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)c(F)cc2Cl)c1
SMILES: COC(=O)C(C)Oc1cccc(C(C)Oc2cc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)c(F)cc2Cl)c1

Molecular Processing

Molecular formula
C24H21ClF4N2O6
Molecular weight
544.89
Exact mass
544.1024
XLogP
4.43
TPSA
88.76
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
37
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.292
Molar refractivity
124.84

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→