Name: 1-tert-butyl 4-methyl 4-(3-chloropyrazin-2-yl)piperidine-1,4-dicarboxylate
SMILES:
COC(=O)C1(c2nccnc2Cl)CCN(C(=O)OC(C)(C)C)CC1Molecular Processing
Molecular formula
C16H22ClN3O4
Molecular weight
355.82
Exact mass
355.1299
XLogP
2.57
TPSA
81.62
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
87.78
Supplementary Information
Details werden geladen…
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