SMILES:
O=[N+]([O-])c1c(Cl)nc2ccccc2c1NCC1(O)CCSCC1Molecular Processing
Molecular formula
C15H16ClN3O3S
Molecular weight
353.83
Exact mass
353.0601
XLogP
3.47
TPSA
88.29
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
93.41
Supplementary Information
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