الاسم: 1,1-dimethylethyl 3-[[[4-(methoxycarbonyl)phenyl]methyl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate
SMILES:
COC(=O)c1ccc(CNC2CC3CCC(C2)N3C(=O)OC(C)(C)C)cc1Molecular Processing
Molecular formula
C21H30N2O4
Molecular weight
374.48
Exact mass
374.2206
XLogP
3.49
TPSA
67.87
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.619
Molar refractivity
102.53
Supplementary Information
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