SMILES:
O=C1N(c2ccc3ncsc3c2)CCN1c1cnccc1ClMolecular Processing
Molecular formula
C15H11ClN4OS
Molecular weight
330.8
Exact mass
330.0342
XLogP
3.79
TPSA
49.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
88.96
Supplementary Information
Récupération des détails…
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