SMILES:
Cl.O=C(N[C@H]1CN2CCC1CC2)c1sc2ccccc2c1ClMolecular Processing
Molecular formula
C16H18Cl2N2OS
Molecular weight
357.31
Exact mass
356.0517
XLogP
3.8
TPSA
32.34
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.438
Molar refractivity
94.5
Supplementary Information
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