CAS 1083065-09-1

(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl N-[(7R)-6,7-dihydro-5-[(4-methoxyphenyl)methyl]-6-oxo-5H-dibenz[b,d]azepin-7-yl]carbamate

Description:

The chemical substance known as "(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl N-[(7R)-6,7-dihydro-5-[(4-methoxyphenyl)methyl]-6-oxo-5H-dibenz[b,d]azepin-7-yl]carbamate" with CAS number 1083065-09-1 is a complex organic compound characterized by its specific stereochemistry and functional groups. It features a cyclohexyl ring substituted with a methyl and isopropyl group, indicating a branched aliphatic structure. The presence of a carbamate functional group suggests potential biological activity, as carbamates are often associated with pharmacological properties. Additionally, the dibenzodiazepine moiety indicates that this compound may interact with neurotransmitter systems, potentially influencing central nervous system activity. The methoxyphenyl group adds to the compound's lipophilicity, which may affect its solubility and bioavailability. Overall, this compound's intricate structure and functional groups suggest it may have applications in medicinal chemistry, particularly in the development of therapeutic agents. However, specific biological activities and properties would require further investigation through empirical studies.

Formula: C₃₃H₃₈N₂O₄

InChI: InChI=1S/C33H38N2O4/c1-21(2)25-18-13-22(3)19-30(25)39-33(37)34-31-28-11-6-5-9-26(28)27-10-7-8-12-29(27)35(32(31)36)20-23-14-16-24(38-4)17-15-23/h5-12,14-17,21-22,25,30-31H,13,18-20H2,1-4H3,(H,34,37)/t22-,25+,30-,31-/m1/s1

InChI key: InChIKey=IDKCDWYJGGDAKW-BVXIIPPJSA-N

SMILES: C(N1C=2C(C=3C([C@@H](NC(O[C@H]4[C@H](C(C)C)CC[C@@H](C)C4)=O)C1=O)=CC=CC3)=CC=CC2)C5=CC=C(OC)C=C5

Synonyms:

• (1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl N-[(7R)-6,7-dihydro-5-[(4-methoxyphenyl)methyl]-6-oxo-5H-dibenz[b,d]azepin-7-yl]carbamate
• Carbamic acid, N-[(7R)-6,7-dihydro-5-[(4-methoxyphenyl)methyl]-6-oxo-5H-dibenz[b,d]azepin-7-yl]-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester
• [(R)-5-(4-methoxy-benzyl)-6-oxo-6,7-dihydro-5H-dibenzo[b,d]azepin-7-yl]-carbamic acid (1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl ester
• N-[(7R)-6,7-Dihydro-5-[(4-methoxyphenyl)methyl]-6-oxo-5H-dibenz[b,d]azepin-7-yl]-carbamic Acid (1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl ester

(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl N-[(7R)-6,7-dihydro-5-[(4-methoxyphenyl)methyl]-6-oxo-5H-dibenz[b,d]azepin-7-yl]carb amate

CAS: 1083065-09-1

(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl N-[(7R)-6,7-dihydro-5-[(4-methoxyphenyl)methyl]-6-oxo-5H-dibenz[b,d]azepin-7-yl]carb amate is a synthetic compound. It is an impurity in the drug product Brivaracetam (CAS No. 1083065-09-1). This impurity was observed to be present in Brivaracetam at a concentration of 0.0008%. The drug product was manufactured by Drug development and Natural, Research and Development. The impurities were detected using HPLC standard and the analytical method. Impurity standards are available for the synthesis of this compound.

Formula: C₃₃H₃₈N₂O₄

Purity: Min. 95%

Molecular weight: 526.70 g/mol

Ref: 3D-ITB06509