Название: 4-[2-(tert-Butoxycarbonylamino)ethoxy]-3-methoxy-N-[3-[(E)-2-(3-methylphenyl)vinyl]phenyl]phenylacetamide
SMILES:
COc1cc(CC(=O)Nc2cccc(/C=C/c3cccc(C)c3)c2)ccc1OCCNC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C31H36N2O5
Molecular weight
516.64
Exact mass
516.2624
XLogP
6.26
TPSA
85.89
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
38
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.29
Molar refractivity
151.61
Supplementary Information
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