Название: Intermediate 39A
SMILES:
CCOC(=O)c1nc(-c2ccccc2)n2c1CN(C(=O)OC(C)(C)C)CCC2Molecular Processing
Molecular formula
C21H27N3O4
Molecular weight
385.46
Exact mass
385.2002
XLogP
3.87
TPSA
73.66
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.476
Molar refractivity
104.88
Supplementary Information
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