Unknown

Dataset Information

0

6-Cyclo-hexyl-meth-yl-5-ethyl-2-[(2-oxo-2-phenyl-eth-yl)sulfan-yl]pyrimidin-4(3H)-one.

ABSTRACT: In the title compound, C(21)H(26)N(2)O(2)S, the cyclo-hexane ring adopts a chair conformation. The angle at the methyl-ene bridge linking the pyrimidine and cyclo-hexane rings is 113.41?(13)°. This is in the range considered optimal for maximum activity of non-nucleoside reverse transcriptase inhibitors. In the crystal, mol-ecules are connected into centrosymmetric dimers via pairs of N-H?O hydrogen bonds.

SUBMITTER: Yan WL 

PROVIDER: S-EPMC3051611 | biostudies-literature | 2011 Jan

REPOSITORIES: biostudies-literature

Json Xml
altmetric image

Publications

6-Cyclo-hexyl-meth-yl-5-ethyl-2-[(2-oxo-2-phenyl-eth-yl)sulfan-yl]pyrimidin-4(3H)-one.

Yan Wan-Lu WL   Guo Qiong Q   Li Cong C   Ji Xiao-Ying XY   He Yan-Ping YP  

Acta crystallographica. Section E, Structure reports online 20110129 Pt 2

In the title compound, C(21)H(26)N(2)O(2)S, the cyclo-hexane ring adopts a chair conformation. The angle at the methyl-ene bridge linking the pyrimidine and cyclo-hexane rings is 113.41 (13)°. This is in the range considered optimal for maximum activity of non-nucleoside reverse transcriptase inhibitors. In the crystal, mol-ecules are connected into centrosymmetric dimers via pairs of N-H⋯O hydrogen bonds. ...[more]

Similar Datasets

Unknown 6-Cyclo-hexyl-methyl-2-cyclo-hexyl-sul-fanyl-5-isopropyl-pyrimidin-4(3H)-one.
| S-EPMC2960565 | biostudies-literature
Unknown Crystal structure of <i>N</i>-[2-(cyclo-hexyl-sulfan-yl)eth-yl]quinolinic acid imide.
| S-EPMC5588583 | biostudies-literature
Unknown 4-(Cyclo-hexyl-sulfan-yl)-1-[(E)-2-(cyclo-hexyl-sulfan-yl)-1-phenyl-ethen-yl]-3-phenyl-1H-pyrazole.
| S-EPMC2959566 | biostudies-literature
Unknown Ethyl (4-{[(di-ethyl-carbamo-thio-yl)sulfan-yl]meth-yl}-2-oxo-2H-chromen-7-yl)carbamate.
| S-EPMC3998360 | biostudies-literature
Unknown Bis[2-((4,6-dimethyl-pyrimidin-2-yl){2-[(4,6-dimethyl-pyrimidin-2-yl)sulfan-yl]eth-yl}amino)-eth-yl] disulfide.
| S-EPMC2983405 | biostudies-literature
Unknown N-Cyclo-hexyl-N-{[3-(4,6-dimeth-oxy-pyrimidin-2-yl-oxy)pyridin-2-yl]meth-yl}4,6-dimeth-oxy-pyrimidin-2-amine.
| S-EPMC3344196 | biostudies-literature
Unknown 1-{[(Cyclo-hexyl-oxy)carbon-yl]-oxy}ethyl 3-{[2'-(2-ethyl-2H-tetra-zol-5-yl)biphenyl-4-yl]meth-yl}-2-oxo-2,3-dihydro-1H-benzimidazole-4-carboxyl-ate.
| S-EPMC2983784 | biostudies-literature
Unknown rac-4-{(E)-[1-Cyano-1-cyclo-hexyl-2-(1H-indol-3-yl)eth-yl]imino-meth-yl}benzonitrile.
| S-EPMC3239068 | biostudies-literature
Unknown Ethyl 2-{[4-(pyridin-4-yl)pyrimidin-2-yl]sulfan-yl}acetate.
| S-EPMC3052020 | biostudies-literature
Unknown N-Cyclo-hexyl-2-(2,3-dichloro-phenyl-sulfan-yl)acetamide.
| S-EPMC2967950 | biostudies-literature