200,000+ products from a single source!
sales@angenechem.com
3161-57-7 | 3-HYDROXYMETHYL-1,3-BENZOTHIAZOLE-2-THIONE
CAS No: 3161-57-7 Catalog No: AG00BY3E MDL No:
Product Description
Catalog Number:
AG00BY3E
Chemical Name:
3-HYDROXYMETHYL-1,3-BENZOTHIAZOLE-2-THIONE
CAS Number:
3161-57-7
IUPAC Name:
3-(hydroxymethyl)-1,3-benzothiazole-2-thione
InChI:
InChI=1S/C8H7NOS2/c10-5-9-6-3-1-2-4-7(6)12-8(9)11/h1-4,10H,5H2
InChI Key:
SDMPSCVFJMUEOS-UHFFFAOYSA-N
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.997g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.27g/mol
Monoisotopic Mass:
196.997g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Inhibitors of the salicylate synthase (MbtI) from Mycobacterium tuberculosis discovered by high-throughput screening. | ChemMedChem 20101203 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.