SMILES:
CCCc1cc(C)c(OCCNC2=c3ccsc3=NCN2C)c(Cl)c1Molecular Processing
Molecular formula
C19H24ClN3OS
Molecular weight
377.94
Exact mass
377.1329
XLogP
2.92
TPSA
36.86
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.421
Molar refractivity
104.82
Supplementary Information
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