CCCc1c2nc(C(=O)OCC)cc(N)c2cc2c(=O)cc(C(=O)OCC)oc12
Name: Diethyl 6-amino-4-oxo-10-propyl-4H-pyrano[3,2-g]quinoline-2,8-dicarboxylate
SMILES: CCCc1c2nc(C(=O)OCC)cc(N)c2cc2c(=O)cc(C(=O)OCC)oc12

Molecular Processing

Molecular formula
C21H22N2O6
Molecular weight
398.42
Exact mass
398.1478
XLogP
3.23
TPSA
121.72
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
108.11

Supplementary Information

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