SMILES:
CCc1ccc2cc(C)c(C(OC(C)(C)C)C(=O)O)c(-c3ccc(Cl)cc3)c2c1Molecular Processing
Molecular formula
C25H27ClO3
Molecular weight
410.94
Exact mass
410.1649
XLogP
6.97
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.32
Molar refractivity
119.72
Supplementary Information
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