이름: (2S,5R)-6-(benzyloxy)-7-oxo-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid
SMILES:
O=C(O)[C@@H]1CC[C@@H]2CN1C(=O)N2OCc1ccccc1Molecular Processing
Molecular formula
C14H16N2O4
Molecular weight
276.29
Exact mass
276.111
XLogP
1.47
TPSA
70.08
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
69.62
Supplementary Information
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