名称: 2-oxo-4-phenoxybenzothiazoline
SMILES:
O=c1[nH]c2c(Oc3ccccc3)cccc2s1Molecular Processing
Molecular formula
C13H9NO2S
Molecular weight
243.29
Exact mass
243.0354
XLogP
3.38
TPSA
42.09
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
68.96
Supplementary Information
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