CCCCOC(=O)c1nc(N2CC[C@H](N)[C@H](OC)C2)oc1CC
名称: butyl cis(±)-2-(4-amino-3-methoxypiperidin-1-yl)-5-ethyl-1,3-oxazole-4-carboxylate
SMILES: CCCCOC(=O)c1nc(N2CC[C@H](N)[C@H](OC)C2)oc1CC

Molecular Processing

Molecular formula
C16H27N3O4
Molecular weight
325.41
Exact mass
325.2002
XLogP
1.75
TPSA
90.82
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
86.67

Supplementary Information

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