SMILES:
COC(=O)c1ccc([C@@H]2CN(C)C[C@H]2C#N)c(C(=O)OC)c1Molecular Processing
Molecular formula
C16H18N2O4
Molecular weight
302.33
Exact mass
302.1267
XLogP
1.43
TPSA
79.63
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
78.46
Supplementary Information
Récupération des détails…
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