Название: {1-[8-(4-Methoxy-phenyl)-1,4-dioxa-spiro[4.5]dec-8-yl]-propyl}-carbamic acid benzyl ester
SMILES:
CCC(NC(=O)OCc1ccccc1)C1(c2ccc(OC)cc2)CCC2(CC1)OCCO2Molecular Processing
Molecular formula
C26H33NO5
Molecular weight
439.55
Exact mass
439.2359
XLogP
4.96
TPSA
66.02
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
121.62
Supplementary Information
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