Nombre: 4-[benzyl-(1-ethoxycarbonyl-ethyl)-amino]-butyric acid methyl ester
SMILES:
CCOC(=O)C(C)N(CCCC(=O)OC)Cc1ccccc1Molecular Processing
Molecular formula
C17H25NO4
Molecular weight
307.39
Exact mass
307.1784
XLogP
2.39
TPSA
55.84
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
84.2
Supplementary Information
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