Name: 4-(4-bromo-2-fluorophenylamino)-5-fluoro-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid N′-(1-imino-ethyl)-hydrazide
SMILES:
CC(=N)NNC(=O)c1cn(C)c(=O)c(F)c1Nc1ccc(Br)cc1FMolecular Processing
Molecular formula
C15H14BrF2N5O2
Molecular weight
414.21
Exact mass
413.0299
XLogP
2.4
TPSA
99.01
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
93.03
Supplementary Information
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Involved in 20 reactions→