Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

4-(3-Fluoro-4-meth-oxy-phen-yl)-1-(4-meth-oxy-phen-yl)-5-(3,4,5-trimeth-oxy-phen-yl)-1H-imidazole.

ABSTRACT: In the title mol-ecule, C(26)H(25)FN(2)O(5), the fluoro-meth-oxy-, meth-oxy- and trimeth-oxy-substituted benzene rings form dihedral angles of 12.65?(2), 84.15?(2) and 55.67?(2)°, respectively, with the imidazole ring. The crystal structure is stabilized weak inter-molecular C-H?F and C-H?O hydrogen bonds.

SUBMITTER: Zhang XM

PROVIDER: S-EPMC3011382 | biostudies-literature | 2010 Nov

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

4-(3-Fluoro-4-meth-oxy-phen-yl)-1-(4-meth-oxy-phen-yl)-5-(3,4,5-trimeth-oxy-phen-yl)-1H-imidazole.

Zhang Xiao-Meng XM Zhang Cang C Zhang Wen-Ping WP Liu Xiao-Rong XR

Acta crystallographica. Section E, Structure reports online 20101106 Pt 12

In the title mol-ecule, C(26)H(25)FN(2)O(5), the fluoro-meth-oxy-, meth-oxy- and trimeth-oxy-substituted benzene rings form dihedral angles of 12.65 (2), 84.15 (2) and 55.67 (2)°, respectively, with the imidazole ring. The crystal structure is stabilized weak inter-molecular C-H⋯F and C-H⋯O hydrogen bonds. ...[more]

PMID: 21589391

Similar Datasets

2-(4-Fluoro-phen-yl)-1-(3-meth-oxy-phen-yl)-4,5-dimethyl-1H-imidazole.

Project description:In the title compound, C18H17FN2O, the imidazole ring makes dihedral angles of 68.81?(6) and 25.20?(8)° with the meth-oxy-phenyl and fluoro-phenyl rings, respectively. The dihedral angle between the meth-oxy-phenyl and fluoro-phenyl ring is 71.89?(6)°. In the crystal, mol-ecules are linked into inversion dimers with an R 2 (2)(8) graph-set motif by pairs of weak C-H?F inter-actions.

| S-EPMC3914064 | biostudies-literature

2-(4-Fluoro-phen-yl)-1-(4-meth-oxy-phen-yl)-4,5-dimethyl-1H-imidazole.

Project description:In the title compound, C(18)H(17)FN(2)O, the imidazole ring makes dihedral angles of 76.46 (7) and 40.68 (7)° with the meth-oxy-phenyl and fluoro-phenyl rings, respectively. The dihedral angle between the two benzene rings is 71.25 (6)°.

| S-EPMC3006994 | biostudies-literature

1-(4-Meth-oxy-phen-yl)-2-[4-(tri-fluoro-meth-yl)phen-yl]-1H-phenanthro[9,10-d]imidazole.

Project description:In the title compound, C29H19F3N2O, a phenanthroline-fused imidazole tetra-cyclic system, the fused benzene rings deviate slightly from the central ring and make dihedral angles with this ring of 3.47?(8) and 3.05?(8)°. The tri-fluoro-methyl-phenyl ring is roughly coplanar with the phenanthroline-fused imidazole tetra-cyclic system [dihedral angle = 11.02?(6)°], while the meth-oxy-phenyl ring is almost perpendicular [dihedral angle = 87.65?(6)°]. There are intra-molecular C-H ?? inter-actions involving the meth-oxy-phenyl ring and the central phenanthroline ring, as well as an inter-molecular C-H?? inter-action involving the phenanthroline ring. In addition, there is an inter-molecular ?-? inter-action involving the central phenanthroline ring and the tri-fluoro-methyl-phenyl ring [centroid-centroid distance = 3.685?(2)?Å], as well as C-H?N inter-actions linking the mol-ecules into dimers.

| S-EPMC3793785 | biostudies-literature

2-(4-Fluoro-phen-yl)-1-(4-meth-oxy-phen-yl)-1H-phenanthro[9,10-d]imidazole.

Project description:In the title compound, C28H19FN2O, the phenanthrene fused with an imidazole ring, constituting an essentially planar tetra-cyclic system [maximum deviation = 0.032?(2)?Å], makes dihedral angles of 60.83?(4) and 80.55?(4)° with the fluoro-benzene and meth-oxy-benzene rings, respectively. The dihedral angle between the the meth-oxy-benzene and fluoro-benzene rings is 69.45?(6)°. In the crystal, C-H?O hydrogen bonds connect the mol-ecules into infinite strands along the b axis. The crystal structure is further consolidated by C-H?? inter-actions.

| S-EPMC3588432 | biostudies-literature

(E)-1-(4-Meth-oxy-phen-yl)-3-(3,4,5-trimeth-oxy-phen-yl)prop-2-en-1-one.

Project description:The title compound, C(19)H(20)O(5), was synthesized by reaction of 4-meth-oxy-acetophenone and 3,4,5-trimeth-oxy-benzaldehyde. The aromatic rings form a dihedral angle of 36.39?(7)°. Two intramolecular C-H?O hydrogen bonds occur. The crystal packing features weak C-H?O inter-actions.

| S-EPMC3213567 | biostudies-literature

5-Meth-oxy-1-(3,4,5-trimethoxy-phen-yl)-1H-indole.

Project description:The title compound, C(18)H(19)NO(4), was prepared as an indole derivative with possible anti-mitotic properties. The planes of the indole and trimethoxy-phenyl rings make a dihedral angle of 45.35?(5)° with one another. In the crystal, mol-ecules related by a twofold screw axis exhibit arene C-H?arene-? inter-actions which are 3.035?(1)?Å in length.

| S-EPMC3007039 | biostudies-literature

N-(4-Bromo-phen-yl)-3,4,5-trimeth-oxy-benzamide.

Project description:In the title compound, C(16)H(16)BrNO(4), the dihedral angle between the two aromatic rings is 67.51?(25)°. In the crystal, mol-ecules are linked by N-H?O hydrogen bonds involving the N-H and C=O groups of the amide function, leading to a chain along [-101].

| S-EPMC3379256 | biostudies-literature

3,4,5-Trimeth-oxy-N-(2-methoxy-phen-yl)benzamide.

Project description:In the title mol-ecule, C(17)H(19)NO(5), the amide plane is oriented at an angle of 41.5?(3)° with respect to the 2-methoxy-benzene ring. The three meth-oxy groups lie almost in the plane of the aromatic rings to which they are attached [C-O-C-C torsion angles of of 0.7?(4), -13.4?(4) and 3.1?(4)°], whereas the meth-oxy group at the 4-position of the 3,4,5-trimethoxy-benzene ring is nearly perpendicularly oriented [C-O-C-C torsion angle of 103.9?(3)°]. In the crystal structure, inter-molecular N-H?O hydrogen bonds link the mol-ecules into chains along [001].

| S-EPMC2977507 | biostudies-literature

1-(3,5-Dimeth-oxy-phen-yl)-2-(4-fluoro-phen-yl)-4,5-dimethyl-1H-imidazole.

Project description:In the title compound, C(19)H(19)FN(2)O(2), the imidazole ring is essentially planar [maximum deviation = 0.0030 (8) Å] and makes dihedral angles of 66.45 (7) and 29.98 (7)° with the benzene rings attached to the ring N and C atoms, respectively. The dihedral angle between the two benzene rings is 64.79 (7)°. A C-H⋯π inter-action is found in the crystal structure. The two meth-oxy groups were found to be disordered over two sets of sites with occupancy factors of 0.803 (4) and 0.197 (4). The F atom is disordered over two sites with occupancy factors of 0.929 (4) and 0.071 (4).

| S-EPMC3274949 | biostudies-literature

5-{2-(4-Chloro-phen-yl)-1-[2-(4-chloro-phen-yl)-1-(3,4,5-trimeth-oxy-phen-yl)eth-oxy]eth-yl}-1,2,3-trimeth-oxy-benzene.

Project description:The title compound, C(34)H(36)Cl(2)O(7), is a by-product from the reaction of 4-chloro-benzyl-zinc chloride with 3,4,5-trimeth-oxy-benzaldehyde. In each of the two 1,2-diphenyl-ethyl moieties, the two benzene rings are arranged in a trans conformation and make C(ar)-C-C-C(ar) torsion angles of 163.64 (19) and 174.43 (18)°. The crystal structure is stabilized by van der Waals inter-actions only.

| S-EPMC3343973 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

Tweets

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data