SMILES:
O=C(O)CC(=O)N1CCN(C(=O)c2ccccc2Br)CC1Molecular Processing
Molecular formula
C14H15BrN2O4
Molecular weight
355.19
Exact mass
354.0215
XLogP
1.21
TPSA
77.92
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
78.88
Supplementary Information
Details werden geladen…
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