Name: 5-(ethoxycarbonyloxy)-1,2,4,5-tetrahydro-11-methyl-3-azepino[4,5-b]quinoline-carboxylic acid ethyl ester
SMILES:
CCOC(=O)OC1CN(C(=O)OCC)CCc2c1nc1ccccc1c2CMolecular Processing
Molecular formula
C20H24N2O5
Molecular weight
372.42
Exact mass
372.1685
XLogP
3.77
TPSA
77.96
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
99.63
Supplementary Information
Details werden geladen…
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