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650635-68-0 | 4,7-Benzothiazoledione,2,5-dimethyl-(9CI)
CAS No: 650635-68-0 Catalog No: AG00EOB6 MDL No:
Product Description
Catalog Number:
AG00EOB6
Chemical Name:
4,7-Benzothiazoledione,2,5-dimethyl-(9CI)
CAS Number:
650635-68-0
IUPAC Name:
2,5-dimethyl-1,3-benzothiazole-4,7-dione
InChI:
InChI=1S/C9H7NO2S/c1-4-3-6(11)9-7(8(4)12)10-5(2)13-9/h3H,1-2H3
InChI Key:
FUHJILFPCUXBFQ-UHFFFAOYSA-N
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.02g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.22g/mol
Monoisotopic Mass:
193.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Synthesis and antifungal activity of 6-arylthio-/6-arylamino-4,7-dioxobenzothiazoles. | Bioorganic & medicinal chemistry 20030901 |
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