Name: 4-hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylic acid chloride-1,1-dioxide
SMILES:
CN1C(C(=O)Cl)=C(O)c2ccccc2S1(=O)=OMolecular Processing
Molecular formula
C10H8ClNO4S
Molecular weight
273.7
Exact mass
272.9863
XLogP
1.31
TPSA
74.68
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
61.8
Supplementary Information
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