Name: (R)-2-(5-bromo-4-cyano-2-fluorophenylamino)-4-methylpentanamide
SMILES:
CC(C)C[C@@H](Nc1cc(Br)c(C#N)cc1F)C(N)=OMolecular Processing
Molecular formula
C13H15BrFN3O
Molecular weight
328.19
Exact mass
327.0383
XLogP
2.77
TPSA
78.91
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
74.88
Supplementary Information
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Involved in 4 reactions→