CAS 126320-77-2

(5S)-4,5,6,7-Tetrahydro-5-methyl-6-(3-methyl-2-buten-1-yl)imidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione

Description:

(5S)-4,5,6,7-Tetrahydro-5-methyl-6-(3-methyl-2-buten-1-yl)imidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione, with CAS number 126320-77-2, is a complex organic compound characterized by its unique bicyclic structure that incorporates both imidazole and benzodiazepine moieties. This compound features a thione functional group, which is a sulfur-containing analogue of a ketone, contributing to its reactivity and potential biological activity. The presence of multiple chiral centers indicates that it may exist in various stereoisomeric forms, which can significantly influence its pharmacological properties. The compound's structure suggests potential interactions with biological targets, making it of interest in medicinal chemistry, particularly in the development of therapeutic agents. Its hydrophobic regions may enhance membrane permeability, while the thione group could participate in various chemical reactions, including nucleophilic attacks. Overall, this compound exemplifies the intricate relationship between molecular structure and biological function, warranting further investigation into its potential applications in drug discovery and development.

Formula: C₁₆H₂₁N₃S

InChI: InChI=1S/C16H21N3S/c1-11(2)7-8-18-10-13-5-4-6-14-15(13)19(9-12(18)3)16(20)17-14/h4-7,12H,8-10H2,1-3H3,(H,17,20)/t12-/m0/s1

InChI key: InChIKey=WTTIBCHOELPGFK-LBPRGKRZSA-N

SMILES: S=C1N2C3=C(CN(CC=C(C)C)[C@@H](C)C2)C=CC=C3N1

Synonyms:

• R 82150
• Imidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione, 4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-buten-1-yl)-, (5S)-
• Imidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione, 4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-butenyl)-, (5S)-
• Imidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione, 4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-butenyl)-, (S)-
• (5S)-4,5,6,7-Tetrahydro-5-methyl-6-(3-methyl-2-buten-1-yl)imidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione

R 82150

CAS: 126320-77-2

R 82150 is an antiviral and a member of the tetrahydroimidazo[4,5,1-jk]-[1,4]-benzodiazepin-2(1H)-thione family.

Formula: C₁₆H₂₁N₃S

Purity: 98%

Color and Shape: Solid

Molecular weight: 287.42

Ref: TM-T26023