Structures of the hydrate and dihydrate forms of the DNA-binding radioprotector methyl-pro-amine.

Autor: White JM; School of Chemistry and BIO-21 Institute, University of Melbourne, Parkville, VIC 3010, Melbourne, Australia., Brydon SC; School of Chemistry and BIO-21 Institute, University of Melbourne, Parkville, VIC 3010, Melbourne, Australia., Fellowes T; School of Chemistry and BIO-21 Institute, University of Melbourne, Parkville, VIC 3010, Melbourne, Australia.
Jazyk: angličtina
Zdroj: Acta crystallographica. Section E, Crystallographic communications [Acta Crystallogr E Crystallogr Commun] 2018 Nov 30; Vol. 74 (Pt 12), pp. 1903-1907. Date of Electronic Publication: 2018 Nov 30 (Print Publication: 2018).
DOI: 10.1107/S2056989018016791
Abstrakt: Methyl pro-amine { N , N ,3-trimethyl-4-[6-(4-methyl-piperazin-1-yl)-1 H ,3' H -[2,5'-bibenzo[ d ]imidazol]-2'-yl]aniline}, C 28 H 35 N 7 O 2 , crystallized as both a dihydrate, C 28 H 31 N 7 ·2H 2 O, and monohydrate, C 28 H 31 N 7 ·H 2 O, form from water in the presence of β-cyclo-dextrin, in the P 2 1 / c and P 2 1 / n space groups, respectively. The two structures adopt different conformations and tautomeric forms as a result of the differing crystal packing as dictated by hydrogen-bonding inter-actions. The dihydrate crystallizes as a three-dimensional hydrogen-bonded network, while the monohydrate crystallizes as a two-dimensional hydrogen-bonded network.
Databáze: MEDLINE