Name: (R)-1-[2-formyloxy-5-nitro-6-methylaminopyridin-4-yl]piperidine-3-carbamic acid tert-butyl ester
SMILES:
CNc1nc(OC=O)cc(N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-]Molecular Processing
Molecular formula
C17H25N5O6
Molecular weight
395.42
Exact mass
395.1805
XLogP
2.06
TPSA
135.93
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
28
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
101.73
Supplementary Information
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