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Structure
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| Relationships |
Total Number of functionally related protein(s) :
9
Total Number of Articles : 9
|
| PubChem |
1510379
|
| Molecular Formula |
C14H10FNOS |
| SMILES |
CC1=CC=CC=C1N2C(=O)C3=C(S2)C=C(C=C3)F |
| InChI |
InChI=1S/C14H10FNOS/c1-9-4-2-3-5-12(9)16-14(17)11-7-6-10(15)8-13(11)18-16/h2-8H,1H3 |
| synonyms |
- Thr101
- 727664-79-1
- 6-fluoro-2-(2-methylphenyl)-1,2-benzothiazol-3-one
- MLS000729299
- MLS003116058
- KUC103866N
- SMR000307577
- 6-fluoro-2-(2-methylphenyl)-1,2-benzisothiazol-3(2H)-one
- 6-Fluoro-2-(2-methylphenyl)-1, 2-benzothiazol-3(2H)-one; 6-Fluoro-2-o-tolylbenzo[d] isothiazol-3(2H)-one
- SCHEMBL2409405
- CHEMBL1310318
- BDBM34849
- CHEBI:92792
- cid_1510379
- BUIZTXXZBDUOCR-UHFFFAOYSA-N
- HMS2706F16
- STK779992
- AKOS001748415
- KSC-09-010
- DA-78445
- HY-124890
- CS-0088804
- 6-fluoro-2-(o-tolyl)-1,2-benzothiazol-3-one
- Q27164553
- 6-fluoranyl-2-(2-methylphenyl)-1,2-benzothiazol-3-one
- 6-fluoro-2-(2-methylphenyl)-1,2-benzothiazol-3(2H)-one
- 1,2-Benzisothiazol-3(2H)-one, 6-fluoro-2-(2-methylphenyl)-
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| Properties |
| Property |
Value |
| MW |
259.30 g/mol |
| HBD |
0 |
| HBA |
3 |
| Rotatable Bond Count |
1 |
| Exact Mass |
259.04671328 g/mol |
| Monoisotopic Mass |
259.04671328 g/mol |
| Heavy Atom Count |
18 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
338 |
| xlogp |
3.5 |
| Topological Polar Surface Area |
45.6 |
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