CAS 579482-31-8

4-[3-(2,6-Dimethyl-4-pyridinyl)phenyl]-1,3-dihydro-7-methyl-8-(trifluoromethyl)-2H-1,5-benzodiazepin-2-one

Description:

The chemical substance known as 4-[3-(2,6-Dimethyl-4-pyridinyl)phenyl]-1,3-dihydro-7-methyl-8-(trifluoromethyl)-2H-1,5-benzodiazepin-2-one, with the CAS number 579482-31-8, is a member of the benzodiazepine class of compounds. This compound features a complex structure characterized by a benzodiazepine core, which includes a fused benzene and diazepine ring system. The presence of a trifluoromethyl group enhances its lipophilicity and may influence its biological activity. Additionally, the dimethylpyridine substituent contributes to its potential pharmacological properties, possibly affecting receptor interactions or metabolic pathways. The compound is typically studied for its potential therapeutic applications, particularly in the fields of psychiatry and neurology, due to its ability to modulate neurotransmitter systems. Its specific characteristics, such as solubility, stability, and reactivity, would depend on the molecular interactions dictated by its functional groups and overall structure. As with many benzodiazepines, it may exhibit sedative, anxiolytic, or anticonvulsant effects, although detailed biological activity would require empirical investigation.

Formula: C₂₄H₂₀F₃N₃O

InChI: InChI=1S/C24H20F3N3O/c1-13-7-21-22(11-19(13)24(25,26)27)30-23(31)12-20(29-21)17-6-4-5-16(10-17)18-8-14(2)28-15(3)9-18/h4-11H,12H2,1-3H3,(H,30,31)

InChI key: InChIKey=LYTVXCQQTLUEQR-UHFFFAOYSA-N

SMILES: CC=1C=C2C(=CC1C(F)(F)F)NC(=O)CC(=N2)C3=CC(=CC=C3)C=4C=C(C)N=C(C)C4

Synonyms:

• 4-[3-(2,6-Dimethyl-4-pyridinyl)phenyl]-1,3-dihydro-7-methyl-8-(trifluoromethyl)-2H-1,5-benzodiazepin-2-one
• Ro 4491533
• 2H-1,5-Benzodiazepin-2-one, 4-[3-(2,6-dimethyl-4-pyridinyl)phenyl]-1,3-dihydro-7-methyl-8-(trifluoromethyl)-
• 4-[3-(2,6-Dimethylpyridin-4-yl)phenyl]-7-methyl-8-trifluoromethyl-1,3-dihydrobenzo[b][1,4]diazepin-2-one

Ro4491533

CAS: 579482-31-8

Ro4491533 is a potent and selective negative allosteric modulator for group II of the metabotropic glutamate receptors (mGluR2/3).

Formula: C₂₄H₂₀F₃N₃O

Color and Shape: Solid

Molecular weight: 423.43

Ref: TM-T28600