CCOC(=O)c1ccc(C#Cc2ccc3c(c2)C(OC(C)=O)=CCC3(C)C)cc1
SMILES: CCOC(=O)c1ccc(C#Cc2ccc3c(c2)C(OC(C)=O)=CCC3(C)C)cc1

Molecular Processing

Molecular formula
C25H24O4
Molecular weight
388.46
Exact mass
388.1675
XLogP
4.85
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
112.21

Supplementary Information

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