SMILES:
Cc1nc(NCCSCc2nc[nH]c2C)[nH]c(=O)c1Cc1ccc(Cl)cc1.Cl.ClMolecular Processing
Molecular formula
C19H24Cl3N5OS
Molecular weight
476.86
Exact mass
475.0767
XLogP
4.54
TPSA
86.46
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
3
Fraction Csp3
0.316
Molar refractivity
126.33
Supplementary Information
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