SMILES:
COCC1Cc2c(Oc3ccc(C(=O)N(C)C)cc3)cc(C(=O)OC(C)(C)C)cc2O1Molecular Processing
Molecular formula
C24H29NO6
Molecular weight
427.5
Exact mass
427.1995
XLogP
4.09
TPSA
74.3
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
116.14
Supplementary Information
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