名称: 7-chloro-3-methylthio-2H-1,4-benzothiazine
SMILES:
CSC1=Nc2ccc(Cl)cc2SC1Molecular Processing
Molecular formula
C9H8ClNS2
Molecular weight
229.76
Exact mass
228.9787
XLogP
3.84
TPSA
12.36
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
62.79
Supplementary Information
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