الاسم: 2-methyl-2-{[1-(2-phenoxy-ethoxy)-naphthalene-2-carbonyl]-amino}-butyric acid methyl ester
SMILES:
CCC(C)(NC(=O)c1ccc2ccccc2c1OCCOc1ccccc1)C(=O)OCMolecular Processing
Molecular formula
C25H27NO5
Molecular weight
421.49
Exact mass
421.1889
XLogP
4.37
TPSA
73.86
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
31
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
0.28
Molar refractivity
119.56
Supplementary Information
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