Nombre: product
SMILES:
COc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(-c3ccc(OC)c(Cl)c3)sc2c1Molecular Processing
Molecular formula
C30H30ClNO4S
Molecular weight
536.09
Exact mass
535.1584
XLogP
7.33
TPSA
48
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
37
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
151.04
Supplementary Information
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