N-[2-(azepan-1-yl)-9-isopropyl-9H-purin-6-yl]-4-methoxybenzylamine

被引：8

作者：

Trávnícek, Z

Zatloukal, M

机构：

[1] Palacky Univ, Fac Sci, Dept Inorgan Chem, CZ-77147 Olomouc, Czech Republic

[2] Palacky Univ, Lab Growth Regulators, CZ-78371 Olomouc, Czech Republic

[3] Palacky Univ, AS CR, Inst Expt Bot, CZ-78371 Olomouc, Czech Republic

来源：

ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE | 2004年 / 60卷

关键词：

D O I：

10.1107/S1600536804010207

中图分类号：

O7 [晶体学];

学科分类号：

0702 ; 070205 ; 0703 ; 080501 ;

摘要：

The title compound, C22H30N6O, is a potent inhibitor of estrogen sulfotransferase which catalyses the transfer of a sulfuryl group from 3'-phosphoadenosine 5'-phosphosulfate to estrogen and estrogen-like compounds. The pyrimidine plane forms dihedral angles of 81.53 (4) and 2.99 (4)degrees with the benzene and imidazole rings, respectively. The crystal structure is stabilized by N-H...N hydrogen bonds connecting two adjacent molecules, thus forming centrosymmetric dimers, the N...N distance being 3.0403 (16) Angstrom.

引用

收藏

页码：O924 / O926

页数：3

相关论文

共 16 条

[11] PHASE ANNEALING IN SHELX-90 - DIRECT METHODS FOR LARGER STRUCTURES [J].

SHELDRICK, GM .

ACTA CRYSTALLOGRAPHICA SECTION A, 1990, 46 :467-473

[12] Mixed ligand complexes of platinum(II) and palladium(II) with cytokinin-derived compounds Bohemine and Olomoucine:: X-ray structure of [Pt(BohH+-N7)Cl3]•9/5H2O {Boh=6-(benzylamino)-2-[(3-(hydroxypropyl)-amino]-9-isopropylpurine, Bohemine} [J].

Trávnícek, Z ;

Malon, M ;

Zatloukal, M ;

Dolezal, K ;

Strnad, M ;

Marek, J .

JOURNAL OF INORGANIC BIOCHEMISTRY, 2003, 94 (04) :307-316

[13] Preparation, physicochemical properties and biological activity of copper(II) complexes with 6-(2-chlorobenzylamino)purine (HL1) or 6-(3-chlorobenzylamino)purine (HL2).: The single-crystal X-ray structure of [Cu(H+L2)2Cl3]Cl-2H2O [J].

Trávnícek, Z ;

Malon, M ;

Sindelár, Z ;

Dolezal, K ;

Rolcík, J ;

Krystof, V ;

Strnad, M ;

Marek, J .

JOURNAL OF INORGANIC BIOCHEMISTRY, 2001, 84 (1-2) :23-32

[14] Discovery of estrogen sulfotransferase inhibitors from a purine library screen [J].

Verdugo, DE ;

Cancilla, MT ;

Ge, X ;

Gray, NS ;

Chang, YT ;

Schultz, PG ;

Negishi, M ;

Leary, JA ;

Bertozzi, CR .

JOURNAL OF MEDICINAL CHEMISTRY, 2001, 44 (17) :2683-2686

[15] INHIBITION OF CYCLIN-DEPENDENT KINASES BY PURINE ANALOGS [J].

VESELY, J ;

HAVLICEK, L ;

STRNAD, M ;

BLOW, JJ ;

DONELLADEANA, A ;

PINNA, L ;

LETHAM, DS ;

KATO, J ;

DETIVAUD, L ;

LECLERC, S ;

MEIJER, L .

EUROPEAN JOURNAL OF BIOCHEMISTRY, 1994, 224 (02) :771-786

[16] Synthesis and configuration of the cyclin-dependent kinase inhibitor roscovitine and its enantiomer [J].

Wang, SD ;

McClue, SJ ;

Ferguson, JR ;

Hull, JD ;

Stokes, S ;

Parsons, S ;

Westwood, R ;

Fischer, PM .

TETRAHEDRON-ASYMMETRY, 2001, 12 (20) :2891-2894