N-2-Hydroxyethyl-N-methyl-p-toluenesulfonamide - CAS 59724-61-7
Catalog: |
BB063620 |
Product Name: |
N-2-Hydroxyethyl-N-methyl-p-toluenesulfonamide |
CAS: |
59724-61-7 |
Synonyms: |
N-(2-Hydroxyethyl)-N-methyltoluenesulfonamide; NSC 30139; N-(2-hydroxyethyl)-N,4-dimethylbenzenesulfonamide |
IUPAC Name: | N-(2-hydroxyethyl)-N,4-dimethylbenzenesulfonamide |
Description: | N-2-Hydroxyethyl-N-methyl-p-toluenesulfonamide, is used for the preparation of Rosiglitazone (R693500) derivatives, acting as antidiabetic agents. |
Molecular Weight: | 229.3 |
Molecular Formula: | C10H15NO3S |
Canonical SMILES: | CC1=CC=C(C=C1)S(=O)(=O)N(C)CCO |
InChI: | InChI=1S/C10H15NO3S/c1-9-3-5-10(6-4-9)15(13,14)11(2)7-8-12/h3-6,12H,7-8H2,1-2H3 |
InChI Key: | AGEWHYGRSGMMJE-UHFFFAOYSA-N |
References: | Cantello, B.C.C., et al. J. Med. Chem., 37, 3977 (1994), Oakes, N.D., et al. Diabetes, 43, 1203 (1994), Balton, G.C., et al. Xenobiotica, 26, 627 (1996). |
Complexity: | 276 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.07726451 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.07726451 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 66Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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