Name: ethyl 3-{[(4-{[5-methoxy-1-(5-methoxy-3-methyl-1-benzofuran-2-yl)pentyl]amino}phenyl)carbonyl](methyl)amino}propanoate
SMILES:
CCOC(=O)CCN(C)C(=O)c1ccc(NC(CCCCOC)c2oc3ccc(OC)cc3c2C)cc1Molecular Processing
Molecular formula
C29H38N2O6
Molecular weight
510.63
Exact mass
510.273
XLogP
5.74
TPSA
90.24
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
14
Heavy atoms
37
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.448
Molar refractivity
144.25
Supplementary Information
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