Crystal structures and biological activity of homologated (N)-n-alkylammonium salts of 2-bromo-3-oxido-1,4-naphthoquinone
Homologated (N)- n -alkylammonium salts of 2-bromo-3-oxido-1,4-naphthoquinone (BS-1 to BS-8) have been synthesized and characterized from the single crystal X-ray diffraction experiments combined with density functional theory. The crystal structures revealed diverse noncovalent interactions such as...
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| Veröffentlicht in: | Structural chemistry 2019-12, Vol.30 (6), p.2257-2270 |
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| container_title | Structural chemistry |
| container_volume | 30 |
| creator | Choudhari, Dinkar Chakravarty, Debamitra Lande, Dipali N. Parveen, Sana Gejji, Shridhar P. Kodam, Kisan M. Salunke-Gawali, Sunita |
| description | Homologated (N)-
n
-alkylammonium salts of 2-bromo-3-oxido-1,4-naphthoquinone (BS-1 to BS-8) have been synthesized and characterized from the single crystal X-ray diffraction experiments combined with density functional theory. The crystal structures revealed diverse noncovalent interactions such as hydrogen bonding, π∙∙∙π, Br∙∙∙π, and others. The measured antifungal activities of the BS-1 to BS-6 against fungal strains
Saccharomyces cerevisiae
and
Candida albicans
suggest them to be effective compared to standard drug amphotericin B. Antibacterial activity of BS-1 to BS-6 has been evaluated against Gram-positive and Gram-negative bacteria. |
| doi_str_mv | 10.1007/s11224-019-01343-8 |
| format | Article |
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n
-alkylammonium salts of 2-bromo-3-oxido-1,4-naphthoquinone (BS-1 to BS-8) have been synthesized and characterized from the single crystal X-ray diffraction experiments combined with density functional theory. The crystal structures revealed diverse noncovalent interactions such as hydrogen bonding, π∙∙∙π, Br∙∙∙π, and others. The measured antifungal activities of the BS-1 to BS-6 against fungal strains
Saccharomyces cerevisiae
and
Candida albicans
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n
-alkylammonium salts of 2-bromo-3-oxido-1,4-naphthoquinone (BS-1 to BS-8) have been synthesized and characterized from the single crystal X-ray diffraction experiments combined with density functional theory. The crystal structures revealed diverse noncovalent interactions such as hydrogen bonding, π∙∙∙π, Br∙∙∙π, and others. The measured antifungal activities of the BS-1 to BS-6 against fungal strains
Saccharomyces cerevisiae
and
Candida albicans
suggest them to be effective compared to standard drug amphotericin B. Antibacterial activity of BS-1 to BS-6 has been evaluated against Gram-positive and Gram-negative bacteria.</description><subject>Baking yeast</subject><subject>Biological activity</subject><subject>Chemical bonds</subject><subject>Chemistry</subject><subject>Chemistry and Materials Science</subject><subject>Computer Applications in Chemistry</subject><subject>Crystal structure</subject><subject>Crystals</subject><subject>Density functional theory</subject><subject>Fungicides</subject><subject>Homology</subject><subject>Hydrogen bonding</subject><subject>Original Research</subject><subject>Physical Chemistry</subject><subject>Single crystals</subject><subject>Theoretical and Computational Chemistry</subject><issn>1040-0400</issn><issn>1572-9001</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2019</creationdate><recordtype>article</recordtype><recordid>eNp9kMtKxDAUhosoOI6-gKuCGwWjuTSTZimDNxDd6Drk1pmMbTMmqdi3N2MFdy4OCed8_znwFcUpglcIQnYdEcK4AhDxXKQioN4rZogyDDiEaD__YQVBLnhYHMW4yU20IHRWjMswxiTbMqYw6DQEG0vZm1I53_qV03kidXKfLo2lb8q173Z9mawpz58vQA9k-z62sut874aujLJNcQdioEJmAQH-yxkP0GUFerldp7X_GFzve3tcHDSyjfbk950Xb3e3r8sH8PRy_7i8eQKaIJ4A4o0kylitiIJqoZisGbIMK0YNpgvNKDKKVowpixpCeV3JGltJrTGKcW3JvDib9m5DPm1jEhs_hD6fFJhka5yTBc8UnigdfIzBNmIbXCfDKBAUO8ViUiyyYvGjWNQ5RKZQzHC_suFv9T-pb-11gHI</recordid><startdate>20191201</startdate><enddate>20191201</enddate><creator>Choudhari, Dinkar</creator><creator>Chakravarty, Debamitra</creator><creator>Lande, Dipali N.</creator><creator>Parveen, Sana</creator><creator>Gejji, Shridhar P.</creator><creator>Kodam, Kisan M.</creator><creator>Salunke-Gawali, Sunita</creator><general>Springer US</general><general>Springer Nature B.V</general><scope>AAYXX</scope><scope>CITATION</scope><orcidid>https://orcid.org/0000-0002-4460-3992</orcidid></search><sort><creationdate>20191201</creationdate><title>Crystal structures and biological activity of homologated (N)-n-alkylammonium salts of 2-bromo-3-oxido-1,4-naphthoquinone</title><author>Choudhari, Dinkar ; Chakravarty, Debamitra ; Lande, Dipali N. ; Parveen, Sana ; Gejji, Shridhar P. ; Kodam, Kisan M. ; Salunke-Gawali, Sunita</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c319t-19fa3bdecb3b0b6b7a871e72b75d256c751db5477be1f35984a82ea5eddb79ce3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2019</creationdate><topic>Baking yeast</topic><topic>Biological activity</topic><topic>Chemical bonds</topic><topic>Chemistry</topic><topic>Chemistry and Materials Science</topic><topic>Computer Applications in Chemistry</topic><topic>Crystal structure</topic><topic>Crystals</topic><topic>Density functional theory</topic><topic>Fungicides</topic><topic>Homology</topic><topic>Hydrogen bonding</topic><topic>Original Research</topic><topic>Physical Chemistry</topic><topic>Single crystals</topic><topic>Theoretical and Computational Chemistry</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Choudhari, Dinkar</creatorcontrib><creatorcontrib>Chakravarty, Debamitra</creatorcontrib><creatorcontrib>Lande, Dipali N.</creatorcontrib><creatorcontrib>Parveen, Sana</creatorcontrib><creatorcontrib>Gejji, Shridhar P.</creatorcontrib><creatorcontrib>Kodam, Kisan M.</creatorcontrib><creatorcontrib>Salunke-Gawali, Sunita</creatorcontrib><collection>CrossRef</collection><jtitle>Structural chemistry</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Choudhari, Dinkar</au><au>Chakravarty, Debamitra</au><au>Lande, Dipali N.</au><au>Parveen, Sana</au><au>Gejji, Shridhar P.</au><au>Kodam, Kisan M.</au><au>Salunke-Gawali, Sunita</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Crystal structures and biological activity of homologated (N)-n-alkylammonium salts of 2-bromo-3-oxido-1,4-naphthoquinone</atitle><jtitle>Structural chemistry</jtitle><stitle>Struct Chem</stitle><date>2019-12-01</date><risdate>2019</risdate><volume>30</volume><issue>6</issue><spage>2257</spage><epage>2270</epage><pages>2257-2270</pages><issn>1040-0400</issn><eissn>1572-9001</eissn><abstract>Homologated (N)-
n
-alkylammonium salts of 2-bromo-3-oxido-1,4-naphthoquinone (BS-1 to BS-8) have been synthesized and characterized from the single crystal X-ray diffraction experiments combined with density functional theory. The crystal structures revealed diverse noncovalent interactions such as hydrogen bonding, π∙∙∙π, Br∙∙∙π, and others. The measured antifungal activities of the BS-1 to BS-6 against fungal strains
Saccharomyces cerevisiae
and
Candida albicans
suggest them to be effective compared to standard drug amphotericin B. Antibacterial activity of BS-1 to BS-6 has been evaluated against Gram-positive and Gram-negative bacteria.</abstract><cop>New York</cop><pub>Springer US</pub><doi>10.1007/s11224-019-01343-8</doi><tpages>14</tpages><orcidid>https://orcid.org/0000-0002-4460-3992</orcidid></addata></record> |
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| subjects | Baking yeast Biological activity Chemical bonds Chemistry Chemistry and Materials Science Computer Applications in Chemistry Crystal structure Crystals Density functional theory Fungicides Homology Hydrogen bonding Original Research Physical Chemistry Single crystals Theoretical and Computational Chemistry |
| title | Crystal structures and biological activity of homologated (N)-n-alkylammonium salts of 2-bromo-3-oxido-1,4-naphthoquinone |
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