SMILES:
COC(=O)c1cc(Br)c2oc(N3CCOCC3)cc(=O)c2c1Molecular Processing
Molecular formula
C15H14BrNO5
Molecular weight
368.18
Exact mass
367.0055
XLogP
2.18
TPSA
68.98
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
84.56
Supplementary Information
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