5-Methyl-2-pyridinesulfonamide - CAS 65938-77-4
Catalog: |
BB032865 |
Product Name: |
5-Methyl-2-pyridinesulfonamide |
CAS: |
65938-77-4 |
Synonyms: |
5-methylpyridine-2-sulfonamide |
IUPAC Name: | 5-methylpyridine-2-sulfonamide |
Description: | 5-Methyl-2-pyridinesulfonamide (CAS# 65938-77-4) is a arylsulfonamide used as an intermeditae in the preparation of the endothelin receptor antagonist, Clazosentan. 5-Methyl-2-pyridinesulfonamide is also used as a reagent in the preparation of aziridines via copper or iron-catalyzed aziridination. |
Molecular Weight: | 172.20 |
Molecular Formula: | C6H8N2O2S |
Canonical SMILES: | CC1=CN=C(C=C1)S(=O)(=O)N |
InChI: | InChI=1S/C6H8N2O2S/c1-5-2-3-6(8-4-5)11(7,9)10/h2-4H,1H3,(H2,7,9,10) |
InChI Key: | HXURYNQXMBRJLU-UHFFFAOYSA-N |
Boiling Point: | 361.3 °C at 760 mmHg |
Density: | 1.346 g/cm3 |
MDL: | MFCD00661363 |
LogP: | 1.81850 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020073011-A1 | Compounds and compositions for treating conditions associated with apj receptor activity | 20181005 |
TW-202028210-A | Compounds and compositions for treating conditions associated with apj receptor activity | 20181005 |
CN-113490668-A | Compounds and compositions for treating diseases associated with APJ receptor activity | 20181005 |
EP-3860998-A1 | Compounds and compositions for treating conditions associated with apj receptor activity | 20181005 |
CN-110139858-A | The sulfonamide analog of meat cup fungi lactone | 20161205 |
PMID | Publication Date | Title | Journal |
18327956 | 20080404 | Copper-nitrenoid formation and transfer in catalytic olefin aziridination utilizing chelating 2-pyridylsulfonyl moieties | The Journal of organic chemistry |
15496111 | 20041028 | Notable coordination effects of 2-pyridinesulfonamides leading to efficient aziridination and selective aziridine ring opening | Organic letters |
Complexity: | 219 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.03064868 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.03064868 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 81.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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Pyridines
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