Name: Intermediate 129
SMILES:
Cc1cncc2cccc(O[C@H]3CC[C@H](NC(=O)OC(C)(C)C)CC3)c12Molecular Processing
Molecular formula
C21H28N2O3
Molecular weight
356.47
Exact mass
356.21
XLogP
4.76
TPSA
60.45
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.524
Molar refractivity
102.52
Supplementary Information
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