N-(2-Fluorophenyl)-5-[(4-methoxyphenyl)aminomethyl]-6-methyl-2-phenylpyrimidin-4-amine

被引：4

作者：

Cieplik, Jerzy ^{[2
]}

Pluta, Janusz ^{[2
]}

Bryndal, Iwona ^{[1
,3
]}

Lis, Tadeusz ^{[1
]}

机构：

[1] Univ Wroclaw, Fac Chem, PL-50383 Wroclaw, Poland

[2] Med Acad, Dept Organ Chem, PL-50137 Wroclaw, Poland

[3] Wroclaw Univ Econ, Fac Engn & Econ, Dept Bioorgan Chem, PL-53345 Wroclaw, Poland

来源：

ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE | 2011年 / 67卷

关键词：

data-to-parameter ratio = 36.4; mean σ(C-C) = 0.002 Å; R factor = 0.044; single-crystal X-ray study; T = 85 K; wR factor = 0.121;

D O I：

10.1107/S1600536811045028

中图分类号：

O7 [晶体学];

学科分类号：

0702 ; 070205 ; 0703 ; 080501 ;

摘要：

The conformation of the title molecule, C(25)H(23)FN(4)O, is mainly determined by an intramolecular N-H center dot center dot center dot N hydrogen bond closing a six-membered ring and the dihedral angles between the pyrimidine ring and the three benzene rings which are 12.8 (2), 12.0 (2) and 86.1 (2)degrees. An intramolecular N-H center dot center dot center dot F interaction also occurs. The crystal stucture is stabilized by weak C-H center dot center dot center dot O and C-H center dot center dot center dot pi interactions. An intermolecular N-H center dot center dot center dot N interaction is also observed.

引用

页码：O3162 / U1570

页数：13

共 7 条

[1]

[Anonymous], 2007, CRYSALIS CCD CRYSALI

[2]

CIEPLIK J, 1995, FARMACO, V50, P131

[3]

Cieplik J, 2003, Boll Chim Farm, V142, P146

[4] Two polymorphic forms of N-(4-chlorophenyl)-5-[(4-chlorophenyl)aminomethyl]-6-methyl-2-phenylpyrimidin-4-amine [J].

Cieplik, J ;

Pluta, J ;

Bryndal, I ;

Lis, T .

ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY, 2006, 62 :O259-O261

[5]

Cieplik J, 2008, ACTA POL PHARM, V65, P427

[6]

Pluta J, 1996, Boll Chim Farm, V135, P459

[7] A short history of SHELX [J].

Sheldrick, George M. .

ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, 2008, 64 :112-122

← 1 →