1-Allyl-3′-phenyl-6′H-spiro[indoline-3,4′-isoxazolo[4′,5′:5,6]pyrido[2,3-d]pyrimidine]-2,5′,7′(8′H,9′H)-trione dimethyl sulfoxide monosolvate
In the title solvated compound, C24H17N5O4·C2H6OS, the solvent molecule, dimethyl sulfoxide, is linked to the title molecule by an N—H...O hydrogen bond. The pyridine ring adopts a twist-boat conformation. The isoxazole ring is inclined to the indoline ring system, the pyrimidine ring, and the pheny...
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2017-01-01
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| Series: | IUCrData |
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| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314616020447 |
| _version_ | 1818549012538589184 |
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| author | P. Seethalakshmi C. Palanivel |
| author_facet | P. Seethalakshmi C. Palanivel |
| author_sort | P. Seethalakshmi |
| collection | DOAJ |
| description | In the title solvated compound, C24H17N5O4·C2H6OS, the solvent molecule, dimethyl sulfoxide, is linked to the title molecule by an N—H...O hydrogen bond. The pyridine ring adopts a twist-boat conformation. The isoxazole ring is inclined to the indoline ring system, the pyrimidine ring, and the phenyl ring by 82.31 (7), 10.41 (8) and 53.77 (10)°, respectively. There is an intramolecular C—H...π interaction present involving the phenyl ring and the indoline ring system. In the crystal, molecules are connected by two pairs of N—H...O hydrogen bonds, forming chains along the b-axis direction, and enclosing R22(8) and R22(14) ring motifs. The chains are linked by C—H...O and C—H...N hydrogen bonds and offset π–π interactions, between the pyrimidine and isoxazole rings of inversion-related molecules [centroid–centroid distance = 3.7140 (9) Å], forming a three-dimensional structure. |
| first_indexed | 2024-12-12T08:27:54Z |
| format | Article |
| id | doaj.art-a8ff956fa8b7497abf2fd98de52f5323 |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-12-12T08:27:54Z |
| publishDate | 2017-01-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-a8ff956fa8b7497abf2fd98de52f53232022-12-22T00:31:11ZengInternational Union of CrystallographyIUCrData2414-31462017-01-0121x16204410.1107/S2414314616020447su40901-Allyl-3′-phenyl-6′H-spiro[indoline-3,4′-isoxazolo[4′,5′:5,6]pyrido[2,3-d]pyrimidine]-2,5′,7′(8′H,9′H)-trione dimethyl sulfoxide monosolvateP. Seethalakshmi0C. Palanivel1Research scholar, Bharathiyar University, Coimbatore 641 046, IndiaPG & Research Department of Chemistry, Government Arts College, Chidambaram, IndiaIn the title solvated compound, C24H17N5O4·C2H6OS, the solvent molecule, dimethyl sulfoxide, is linked to the title molecule by an N—H...O hydrogen bond. The pyridine ring adopts a twist-boat conformation. The isoxazole ring is inclined to the indoline ring system, the pyrimidine ring, and the phenyl ring by 82.31 (7), 10.41 (8) and 53.77 (10)°, respectively. There is an intramolecular C—H...π interaction present involving the phenyl ring and the indoline ring system. In the crystal, molecules are connected by two pairs of N—H...O hydrogen bonds, forming chains along the b-axis direction, and enclosing R22(8) and R22(14) ring motifs. The chains are linked by C—H...O and C—H...N hydrogen bonds and offset π–π interactions, between the pyrimidine and isoxazole rings of inversion-related molecules [centroid–centroid distance = 3.7140 (9) Å], forming a three-dimensional structure.http://scripts.iucr.org/cgi-bin/paper?S2414314616020447crystal structurespiroindolineisooxazolopyrimidinehydrogen bondingC—H...π interactions |
| spellingShingle | P. Seethalakshmi C. Palanivel 1-Allyl-3′-phenyl-6′H-spiro[indoline-3,4′-isoxazolo[4′,5′:5,6]pyrido[2,3-d]pyrimidine]-2,5′,7′(8′H,9′H)-trione dimethyl sulfoxide monosolvate IUCrData crystal structure spiro indoline isooxazolo pyrimidine hydrogen bonding C—H...π interactions |
| title | 1-Allyl-3′-phenyl-6′H-spiro[indoline-3,4′-isoxazolo[4′,5′:5,6]pyrido[2,3-d]pyrimidine]-2,5′,7′(8′H,9′H)-trione dimethyl sulfoxide monosolvate |
| title_full | 1-Allyl-3′-phenyl-6′H-spiro[indoline-3,4′-isoxazolo[4′,5′:5,6]pyrido[2,3-d]pyrimidine]-2,5′,7′(8′H,9′H)-trione dimethyl sulfoxide monosolvate |
| title_fullStr | 1-Allyl-3′-phenyl-6′H-spiro[indoline-3,4′-isoxazolo[4′,5′:5,6]pyrido[2,3-d]pyrimidine]-2,5′,7′(8′H,9′H)-trione dimethyl sulfoxide monosolvate |
| title_full_unstemmed | 1-Allyl-3′-phenyl-6′H-spiro[indoline-3,4′-isoxazolo[4′,5′:5,6]pyrido[2,3-d]pyrimidine]-2,5′,7′(8′H,9′H)-trione dimethyl sulfoxide monosolvate |
| title_short | 1-Allyl-3′-phenyl-6′H-spiro[indoline-3,4′-isoxazolo[4′,5′:5,6]pyrido[2,3-d]pyrimidine]-2,5′,7′(8′H,9′H)-trione dimethyl sulfoxide monosolvate |
| title_sort | 1 allyl 3 phenyl 6 h spiro indoline 3 4 isoxazolo 4 5 5 6 pyrido 2 3 d pyrimidine 2 5 7 8 h 9 h trione dimethyl sulfoxide monosolvate |
| topic | crystal structure spiro indoline isooxazolo pyrimidine hydrogen bonding C—H...π interactions |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314616020447 |
| work_keys_str_mv | AT pseethalakshmi 1allyl3phenyl6hspiroindoline34isoxazolo4556pyrido23dpyrimidine2578h9htrionedimethylsulfoxidemonosolvate AT cpalanivel 1allyl3phenyl6hspiroindoline34isoxazolo4556pyrido23dpyrimidine2578h9htrionedimethylsulfoxidemonosolvate |