Name: 1,1-dimethylethyl (2S,5S)-2-(4-{[(2-fluorophenyl)methyl]oxy}phenyl)-6-oxo-1,7-diazaspiro[4.4]nonane-1-carboxylate
SMILES:
CC(C)(C)OC(=O)N1[C@H](c2ccc(OCc3ccccc3F)cc2)CC[C@@]12CCNC2=OMolecular Processing
Molecular formula
C25H29FN2O4
Molecular weight
440.52
Exact mass
440.2111
XLogP
4.74
TPSA
67.87
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
32
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.44
Molar refractivity
117.58
Supplementary Information
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