Name: ethyl 3-(4-amino-5-fluoropyridine-2-yl)amino-2-(3-chloro-2,4,5-trifluoro-benzoyl)acrylate
SMILES:
CCOC(=O)C(=CNc1cc(N)c(F)cn1)C(=O)c1cc(F)c(F)c(Cl)c1FMolecular Processing
Molecular formula
C17H12ClF4N3O3
Molecular weight
417.75
Exact mass
417.0503
XLogP
3.62
TPSA
94.31
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
28
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
92.6
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→