CAS 66981-77-9

Heptanoic acid, 7-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]-, ethyl ester

Description:

Heptanoic acid, 7-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]-, ethyl ester, identified by CAS number 66981-77-9, is a complex organic compound characterized by its unique structure that combines a heptanoic acid moiety with a thiazepin derivative. This compound features a long hydrophobic carbon chain, which contributes to its solubility properties, while the thiazepin ring introduces heteroatoms and functional groups that may impart biological activity. The presence of the chloro substituent and the dioxido groups suggests potential reactivity and interaction with biological systems. As an ester, it is likely to exhibit properties typical of esters, such as volatility and the ability to undergo hydrolysis. The compound's specific applications and biological effects would depend on its interactions within various chemical environments, making it of interest in fields such as medicinal chemistry and pharmacology. However, detailed studies would be necessary to fully elucidate its characteristics and potential uses.

Formula: C₂₃H₂₉ClN₂O₄S

InChI: InChI=1S/C23H29ClN2O4S/c1-3-30-22(27)12-6-4-5-9-15-25-23-18-10-7-8-11-20(18)26(2)31(28,29)21-16-17(24)13-14-19(21)23/h7-8,10-11,13-14,16,23,25H,3-6,9,12,15H2,1-2H3

InChI key: InChIKey=FEFUFMZSNHPQDX-UHFFFAOYSA-N

SMILES: N(CCCCCCC(OCC)=O)C1C=2C(S(=O)(=O)N(C)C=3C1=CC=CC3)=CC(Cl)=CC2

Synonyms:

• Heptanoic acid, 7-[(3-chloro-6,11-dihydro-6-methyldibenzo[c,f][1,2]thiazepin-11-yl)amino]-, ethyl ester, S,S-dioxide
• Heptanoic acid, 7-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]-, ethyl ester
• Dibenzo[c,f][1,2]thiazepine, heptanoic acid deriv.

Tianeptine EP Impurity B Fumarate

CAS: 66981-77-9

Formula: C₂₃H₂₉ClN₂O₄S·C₄H₄O₄

Color and Shape: White To Off-White Solid

Molecular weight: 465.02 116.07

Ref: 4Z-T-367

Tianeptine Ethyl Ester

Controlled Product

CAS: 66981-77-9

Applications Tianeptine Ethyl Ester is an impurity of Tianeptine (T436800),an tricyclic compound with psychostimulant, anti-ulcer and anti-emetic properties.
References Malen, C., et al.: Experientia, 28, 811 (1972); Safa, A., et al.: J. Biol. Chem., 262, 7884 (1987); Ford, J.M., et al.: Pharmacol. Rev., 42, 155, (1990); Pierre, A., et a.: Cancer Res., 51, 2312 (1991);

Formula: C₂₃H₂₉ClN₂O₄S

Color and Shape: Neat

Molecular weight: 465.01

Ref: TR-T436830

Tianeptine ethyl ester

CAS: 66981-77-9

Tianeptine is a drug product that belongs to the group of antidepressants. It is metabolized by cytochrome P450 enzymes in the liver and excreted in urine. Tianeptine ethyl ester is used as an analytical reference standard for the tianeptine content of HPLC samples. The CAS number for tianeptine ethyl ester is 66981-77-9.

Formula: C₂₃H₂₉ClN₂O₄S

Purity: Min. 95%

Molecular weight: 465.00 g/mol

Ref: 3D-RCA98177

Tianeptine Sodium EP Impurity B

CAS: 66981-77-9

Formula: C₂₃H₂₉ClN₂O₄S

Molecular weight: 465

Ref: ST-EA-CP-T113004