Crystal structure of 5-{3-[2,6-dimethyl- 4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]propyl}- N-(11-hydroxyundecyl)isoxazole-3-carboxamide hemihydrate
| dc.contributor.author | Salorinne, Kirsi | |
| dc.contributor.author | Lahtinen, Tanja | |
| dc.date.accessioned | 2015-05-04T06:47:23Z | |
| dc.date.available | 2015-05-04T06:47:23Z | |
| dc.date.issued | 2015 | |
| dc.identifier.citation | Salorinne, K., & Lahtinen, T. (2015). Crystal structure of 5-{3-[2,6-dimethyl- 4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]propyl}- N-(11-hydroxyundecyl)isoxazole-3-carboxamide hemihydrate. <i>Acta Crystallographica Section E : Crystallographic Communications</i>, <i>71</i>(5), 505-508. <a href="https://doi.org/10.1107/s2056989015007367" target="_blank">https://doi.org/10.1107/s2056989015007367</a> | |
| dc.identifier.other | CONVID_24673400 | |
| dc.identifier.other | TUTKAID_65953 | |
| dc.identifier.uri | https://jyx.jyu.fi/handle/123456789/45758 | |
| dc.description.abstract | The title compound, C29H42N4O5·0.5H2O, comprises four structural units. A flexible propyloxy unit in a gauche conformation, with a -C(H2)-C(H2)-C(H2)-O- torsion angle of -64.32 (18)°, connects an isoxazole ring and an approximately planar phenyloxadiazole ring system [with a maxixmum devation of 0.061 (2) Å], which are oriented almost parallel to one another with a dihedral angle of 10.75 (7)°. Furthermore, a C11-alkyl chain with a terminal hydroxy group links to the 3-position of the isoxazole ring via an amide bond. In the crystal, a half-occupancy solvent water molecule connects to a neighbouring molecule via an intermolecular O-H...O(water) hydrogen bond to the C11-alkyl chain hydroxy group. | |
| dc.language.iso | eng | |
| dc.publisher | International Union of Crystallography | |
| dc.relation.ispartofseries | Acta Crystallographica Section E : Crystallographic Communications | |
| dc.subject.other | crystal structure | |
| dc.subject.other | antiviral | |
| dc.subject.other | WIN derivative | |
| dc.subject.other | isoxazole | |
| dc.subject.other | oxadiazole | |
| dc.title | Crystal structure of 5-{3-[2,6-dimethyl- 4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]propyl}- N-(11-hydroxyundecyl)isoxazole-3-carboxamide hemihydrate | |
| dc.type | article | |
| dc.identifier.urn | URN:NBN:fi:jyu-201504241667 | |
| dc.contributor.laitos | Kemian laitos | fi |
| dc.contributor.laitos | Department of Chemistry | en |
| dc.contributor.oppiaine | Orgaaninen kemia | fi |
| dc.contributor.oppiaine | Nanoscience Center | fi |
| dc.contributor.oppiaine | Organic Chemistry | en |
| dc.contributor.oppiaine | Nanoscience Center | en |
| dc.type.uri | http://purl.org/eprint/type/JournalArticle | |
| dc.date.updated | 2015-04-24T13:21:53Z | |
| dc.type.coar | http://purl.org/coar/resource_type/c_2df8fbb1 | |
| dc.description.reviewstatus | peerReviewed | |
| dc.format.pagerange | 505-508 | |
| dc.relation.issn | 2056-9890 | |
| dc.relation.numberinseries | 5 | |
| dc.relation.volume | 71 | |
| dc.type.version | publishedVersion | |
| dc.rights.copyright | © 2015 the Authors. Published by International Union of Crystallography. This is an Open Access article under the terms of the Creative Commons Attribution Licence. | |
| dc.rights.accesslevel | openAccess | fi |
| dc.rights.url | http://creativecommons.org/licenses/by/2.0/uk/legalcode | |
| dc.relation.doi | 10.1107/s2056989015007367 | |
| dc.type.okm | A1 |
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Ellei muuten mainita, aineiston lisenssi on © 2015 the Authors. Published by International Union of Crystallography. This is an Open Access article under the terms of the Creative Commons Attribution Licence.