COC(=O)C(Cc1ccccc1)Oc1c(Br)cc(-c2c3ccccc3c(Br)c3sc(C)c(C)c23)cc1C1CCCC1
SMILES: COC(=O)C(Cc1ccccc1)Oc1c(Br)cc(-c2c3ccccc3c(Br)c3sc(C)c(C)c23)cc1C1CCCC1

Molecular Processing

Molecular formula
C35H32Br2O3S
Molecular weight
692.51
Exact mass
690.0439
XLogP
10.68
TPSA
35.53
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
41
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
177.43

Supplementary Information

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