Name: Intermediate ( 4a )
SMILES:
CCCCc1nc(Cl)c(C=O)n1Cc1ccc(-c2ccccc2C(=O)OC(C)(C)C)cc1Molecular Processing
Molecular formula
C26H29ClN2O3
Molecular weight
452.98
Exact mass
452.1867
XLogP
6.36
TPSA
61.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.346
Molar refractivity
127.39
Supplementary Information
Details werden geladen…
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