3-Mercaptopropanamide - CAS 763-35-9
Catalog: |
BB058929 |
Product Name: |
3-Mercaptopropanamide |
CAS: |
763-35-9 |
Synonyms: |
Propanamide, 3-mercapto-; Propionamide, 3-mercapto- (6CI,7CI,8CI); 3-Mercaptopropionamide; β-Mercaptopropionamide |
IUPAC Name: | 3-sulfanylpropanamide |
Description: | 3-Mercaptopropanamide is a useful building block, used in the synthesis of cyclic thiolactone peptide derivatives with antibiotic activity, and also in the preparation of polyclonal antibodies against brominated proteins. |
Molecular Weight: | 105.16 |
Molecular Formula: | C3H7NOS |
Canonical SMILES: | C(CS)C(=O)N |
InChI: | InChI=1S/C3H7NOS/c4-3(5)1-2-6/h6H,1-2H2,(H2,4,5) |
InChI Key: | JLSJEUQOXVVCPN-UHFFFAOYSA-N |
References: | George, E. A.; et al. J. Am. Chem. Soc., 130, 4914 (2008); Kambayashi, Y.; et al. Journal of Clinical Biochemistry and Nutrition, 44, 95 (2009).. |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
21417332 | 20110413 | Direct catalytic enantio- and diastereoselective aldol reaction of thioamides | Journal of the American Chemical Society |
21095575 | 20101124 | Cell-penetrant, nanomolar O-GlcNAcase inhibitors selective against lysosomal hexosaminidases | Chemistry & biology |
20171277 | 20100601 | Thiolated quaternary ammonium-chitosan conjugates for enhanced precorneal retention, transcorneal permeation and intraocular absorption of dexamethasone | European journal of pharmaceutics and biopharmaceutics : official journal of Arbeitsgemeinschaft fur Pharmazeutische Verfahrenstechnik e.V |
19576984 | 20090910 | Synthesis, characterization and evaluation of thiolated quaternary ammonium-chitosan conjugates for enhanced intestinal drug permeation | European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences |
16209576 | 20051014 | Important role of the 3-mercaptopropionamide moiety in glutathione: promoting effect on decomposition of the adduct of glutathione with the oxoammonium ion of TEMPO | The Journal of organic chemistry |
Complexity: | 54.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 105.02483502 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 105.02483502 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 44.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.6 |
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