SMILES:
OCCCC1=NN(c2nc3ccccc3s2)C(O)(c2ccc(Cl)cc2)C1Molecular Processing
Molecular formula
C19H18ClN3O2S
Molecular weight
387.89
Exact mass
387.0808
XLogP
4.13
TPSA
68.95
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
26
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
105.82
Supplementary Information
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