SMILES:
COC(=O)CC1CCc2cc(Br)cc3[nH]c(=O)c(=O)n1c23Molecular Processing
Molecular formula
C14H13BrN2O4
Molecular weight
353.17
Exact mass
352.0059
XLogP
1.5
TPSA
81.16
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
80.52
Supplementary Information
Obteniendo detalles…
Participa en 120 reacciones→