Nombre: 1-(5-carbamoylpyridin-2-yl)-piperidin-4-yl 4-nitrophenyl carbonate
SMILES:
NC(=O)c1ccc(N2CCC(OC(=O)Oc3ccc([N+](=O)[O-])cc3)CC2)nc1Molecular Processing
Molecular formula
C18H18N4O6
Molecular weight
386.36
Exact mass
386.1226
XLogP
2.27
TPSA
137.89
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
98.2
Supplementary Information
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