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1.
Acta Crystallogr Sect E Struct Rep Online ; 66(Pt 5): o1123, 2010 Apr 21.
Artigo em Inglês | MEDLINE | ID: mdl-21579173

RESUMO

In the title compound, C(20)H(19)N(3)O, the dihedral angles formed by the pyrazolone ring with the two phenyl rings are 64.27 (6) and 17.00 (6)°. The mol-ecular structure is stabilized by intra-molecular N-H⋯O and C-H⋯O hydrogen bonds. In the crystal, the mol-ecules are linked into chains along the b axis by inter-molecular C-H⋯O hydrogen bonds.

2.
Acta Crystallogr Sect E Struct Rep Online ; 66(Pt 6): o1309, 2010 May 12.
Artigo em Inglês | MEDLINE | ID: mdl-21579404

RESUMO

The title compound, C(20)H(19)N(3)O, exists in a keto-enamine tautomeric form. The pyrazolone ring makes dihedral angles of 20.52 (10) and 77.73 (5)° with the two phenyl rings and an intra-molecular N-H⋯O hydrogen bond occurs. A weak inter-molecular C-H⋯O hydrogen bond is observed in the crystal structure. The allyl group is disordered over two positions, with site-occupancy factors of 0.533 (5) and 0.467 (5).

3.
Acta Crystallogr Sect E Struct Rep Online ; 66(Pt 9): o2248, 2010 Aug 11.
Artigo em Inglês | MEDLINE | ID: mdl-21588613

RESUMO

In the title compound, C(18)H(20)N(2)O(3), the dihedral angle between the indole ring system (r.m.s. deviation = 0.018 Å) and the hy-droxy-methyl-enepyrrolidine-2,4-dione plane (r.m.s. deviation = 0.036 Å) is 9.87 (7)°. The keto and enol groups are involved in an intra-molecular O-H⋯O hydrogen bond. An intra-molecular C-H⋯O inter-action also occurs. The sec-butyl group is disordered over two orientations corresponding to an approximate 180° rotation about the N-C bond, with occupancies of 0.670 (6) and 0.330 (6). In the crystal, mol-ecules are linked into chains along the c axis by C-H⋯O hydrogen bonds.

4.
Acta Crystallogr Sect E Struct Rep Online ; 66(Pt 12): o3202, 2010 Nov 17.
Artigo em Inglês | MEDLINE | ID: mdl-21589496

RESUMO

In the title compound, C(16)H(19)NO(4), a potent new herbicide, the dihedral angle between the benzene and pyrrolidine rings is 11.09 (8)°. Intra-molecular O-H⋯O and C-H⋯O hydrogen bonds are observed.

5.
Zhong Xi Yi Jie He Xue Bao ; 7(10): 958-62, 2009 Oct.
Artigo em Chinês | MEDLINE | ID: mdl-19828107

RESUMO

OBJECTIVE: To study the relationship between the inhibitory effects of Tongxie Yaofang, a compound traditional Chinese herbal medicine, on the contraction of the colonic smooth muscle isolated from rats and calcium mobilization. METHODS: By measuring the tension of the isolated colonic smooth muscle strips, the inhibitory effects of Tongxie Yaofang on the contraction induced by acetylcholine (ACh), KCl and exhausting Ca(2+) of internal calcium store were assessed respectively. RESULTS: Tongxie Yaofang could concentration-dependently inhibit the contraction of isolated rat colonic smooth muscle strips induced by KCl and exhausting the Ca(2+) of internal calcium store. Tongxie Yaofang could also inhibit the tension of the second contractile phase induced by ACh (P<0.01, vs control), but had no influence on the first contractile phase. CONCLUSION: Tongxie Yaofang can inhibit the contraction of isolated rat colonic smooth muscle strips mainly by preventing the influx of extracellular Ca(2+), which may be associated with blocking voltage-dependent channel, store-operated channel and receptor-operated channel, but not by preventing the release of internal Ca(2+) from calcium store.


Assuntos
Cálcio/metabolismo , Colo/efeitos dos fármacos , Medicamentos de Ervas Chinesas/farmacologia , Contração Muscular/efeitos dos fármacos , Animais , Colo/fisiologia , Masculino , Músculo Liso , Ratos , Transdução de Sinais/efeitos dos fármacos
6.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 9): o2116, 2009 Aug 08.
Artigo em Inglês | MEDLINE | ID: mdl-21577531

RESUMO

In the title compound, C(21)H(23)N(3)O, the dihedral angles formed by the pyrazolone ring with two phenyl rings are 10.38 (8) and 76.94 (6)°. The sec-butyl-amino group is disordered over two positions, with refined site-occupancy factors of 0.730 (4) and 0.270 (4). The compound could potentially be ligand stabilized in the solid state in a keto-enamine tautomeric form. The amine functionality is involved in an intra-molecular N-H⋯O hydrogen bond, while weak inter-molecular C-H⋯O and C-H⋯N hydrogen bonds participate in the formation of the crystal structure.

7.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 10): m1181-2, 2009 Sep 09.
Artigo em Inglês | MEDLINE | ID: mdl-21577716

RESUMO

In the polymeric title complex, [Cu(C(7)H(3)N(2)O(2)S)(2)(H(2)O)(2)](n), the Cu(II) centre is surrounded by three 1,2,3-benzothia-diazole-7-carboxyl-ate and two water mol-ecules. A 1,2,3-benzothia-diazole-7-carboxyl-ate ligand bridges two Cu(II) centres, with a Cu⋯Cu distance of 9.006 (2) Å. The four O atoms in the equatorial planes around each Cu(II) centre form a distorted square-planar arrangement, while the distorted square-pyramidal coordination is completed by the symmetry-related N atoms of the bridging 1,2,3-benzothia-diazole-7-carboxyl-ate ligands. In the crystal structure, inter-molecular O-H⋯O and O-H⋯N hydrogen bonds link the mol-ecules into a three-dimensional supra-molecular network.

8.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 11): o2740, 2009 Oct 17.
Artigo em Inglês | MEDLINE | ID: mdl-21578335

RESUMO

In the title compound, C(25)H(23)N(3)O(2), the dihedral angles formed by the pyrazolone ring with the three aromatic rings are 14.59 (7), 79.35 (5) and 87.10 (6)°. Three intra-molecular C-H⋯O, C-H⋯N and N-H⋯O hydrogen-bond inter-actions are present. The crystal structure is stabilized by two weak inter-molecular C-H⋯O and C-H⋯N hydrogen-bond inter-actions.

9.
Acta Crystallogr Sect E Struct Rep Online ; 64(Pt 1): o217, 2007 Dec 06.
Artigo em Inglês | MEDLINE | ID: mdl-21200783

RESUMO

The title compound, C(18)H(23)NO(5), a potential herbicide, has an enol group that is intra-molecularly hydrogen bonded to a keto O atom. The dihedral angle between the six-membered ring formed by the enol group and the aromatic benzene ring is 53.35 (6)°.

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