COc1cc(-c2nn(-c3ccc(C=O)cc3)c3ncnc(N)c23)ccc1NC(=O)c1ccc(C(F)(F)F)cc1F
SMILES: COc1cc(-c2nn(-c3ccc(C=O)cc3)c3ncnc(N)c23)ccc1NC(=O)c1ccc(C(F)(F)F)cc1F

Molecular Processing

Molecular formula
C27H18F4N6O3
Molecular weight
550.47
Exact mass
550.1377
XLogP
5.3
TPSA
125.02
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
40
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.074
Molar refractivity
137.8

Supplementary Information

Details werden geladen…

An 35 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→