Name: methyl 4-{[5-methoxy-1-(5-methoxy-3-methyl-1-benzofuran-2-yl)pentyl]amino}benzoate
SMILES:
COCCCCC(Nc1ccc(C(=O)OC)cc1)c1oc2ccc(OC)cc2c1CMolecular Processing
Molecular formula
C24H29NO5
Molecular weight
411.5
Exact mass
411.2046
XLogP
5.51
TPSA
69.93
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
117.38
Supplementary Information
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