NC1=NC(c2cc(Br)ccc2F)(C(F)F)COC1
SMILES: NC1=NC(c2cc(Br)ccc2F)(C(F)F)COC1

Molecular Processing

Molecular formula
C11H10BrF3N2O
Molecular weight
323.11
Exact mass
321.9929
XLogP
2.44
TPSA
47.61
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
64.22

Supplementary Information

Details werden geladen…

An 5 Reaktionen beteiligt