SMILES:
CN(C(=O)CSCOc1ccc(Cl)cc1Cl)C1C2CC3CC1CC(O)(C3)C2Molecular Processing
Molecular formula
C20H25Cl2NO3S
Molecular weight
430.4
Exact mass
429.0932
XLogP
4.46
TPSA
49.77
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
27
Rings
5
Aromatic rings
1
Saturated rings
4
Aliphatic rings
4
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.65
Molar refractivity
109.48
Supplementary Information
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