Name: (R)-benzyl 3-(4-butoxy-4-oxobutanamido)-4-(3′-chlorobiphenyl-4-yl)butanoate
SMILES:
CCCCOC(=O)CCC(=O)N[C@@H](CC(=O)OCc1ccccc1)Cc1ccc(-c2cccc(Cl)c2)cc1Molecular Processing
Molecular formula
C31H34ClNO5
Molecular weight
536.07
Exact mass
535.2126
XLogP
6.29
TPSA
81.7
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
14
Heavy atoms
38
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.323
Molar refractivity
148.48
Supplementary Information
Details werden geladen…
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