The crystal structure of 8-chloro-7-ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, C9H11ClN4O2
نویسندگان
چکیده
منابع مشابه
8-(2-Hydroxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
The title compound, C(13)H(12)N(4)O(3), is an imidazole derivative featuring an annealed purine ring system. The benzimidazole-inspired moiety is essentially planar (r.m.s. of all fitted non-H atoms = 0.0205 Å). An intra-molecular O-H⋯N hydrogen bond occurs. In the crystal, inter-molecular N-H⋯O and C-H⋯O hydrogen bonds are observed, which connect the mol-ecules into chains along [110]. The sho...
متن کامل6-Chloro-8-methyl-4H-3,1-benzoxazine-2,4(1H)-dione
The two mol-ecules in the asymmetric unit of the title compound, C(9)H(6)ClNO(3), are nearly planar, with r.m.s. deviations of 0.034 and 0.037 Å. The crystal structure is stabilized by two weak inter-molecular N-H⋯O inter-actions.
متن کاملCrystal structure of 6-chloro-5-isopropylpyrimidine-2,4(1H,3H)-dione
In the mol-ecule of the title compound, C7H9ClN2O2, the conformation is determined by intra-molecular C-H⋯O and C-H⋯Cl hydrogen bonds, which generate S(6) and S(5) ring motifs. The isopropyl group is almost perpendicular to the pyrimidine ring with torsion angles of -70.8 (3) and 56.0 (3)°. In the crystal, two inversion-related mol-ecules are linked via a pair of N-H⋯O hydrogen bonds into R 2 (...
متن کاملCrystal structure of 2-[(5',6',7',8'-tetrahydro-5',5',8',8'-tetramethyl)-2'-naphthyl]-1-ethyl-1H-benzimidazole-5-carboxylic acid ethyl ester.
retinoids with a tetrahydronaphthalene structure (Fig. 1), was synthesized using an NaHSO3 addition product of 5,6,7,8tetrahydro-5,5,8,8-tetramethyl-2-naphthalene-carboxaldehyde (compound I) as a starting material, which was prepared as described.1 The condensation of compound I and 4-ethylamino3-amino-ethylbenzoate (mp: 73 ̊C) in DMF for 70 h gave the title compound (recrystallized from hexane/...
متن کاملMonoclinic polymorph of 3,7-dimethyl-1-(5-oxohexyl)-3,7-dihydro-1H-purine-2,6-dione
The structure of the title compound, pentoxifylline, C(13)H(18)N(4)O(3), has been previously characterized as a triclinic polymorph [Pavelčík et al. (1989 ▶). Acta Cryst. C45, 836-837]. We have discovered the monoclinic form. There are no strong hydrogen bonds in the crystal structure, rather, moderate C-H⋯O hydrogen bonds are present, which serve to stabilize the three-dimensional architecture.
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ژورنال
عنوان ژورنال: Zeitschrift für Kristallographie - New Crystal Structures
سال: 2018
ISSN: 2197-4578,1433-7266
DOI: 10.1515/ncrs-2017-0314