MedKoo Cat#: 414547 | Name: Toludesvenlafaxine HCl hydrate

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Toludesvenlafaxine HCl is used in the treatment of Depression

Chemical Structure

Toludesvenlafaxine HCl hydrate
CAS#2137075-66-0 (HCl hydrate)

Theoretical Analysis

MedKoo Cat#: 414547

Name: Toludesvenlafaxine HCl hydrate

CAS#: 2137075-66-0 (HCl hydrate)

Chemical Formula: C24H36ClNO5

Exact Mass: 453.2282

Molecular Weight: 454.00

Elemental Analysis: C, 63.49; H, 7.99; Cl, 7.81; N, 3.09; O, 17.62

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Synonym
Toludesvenlafaxine hydrochloride; Toludesvenlafaxine HCl; LPM 570065; LPM-570065; LPM570065; LY03005 hydrochloride dihydrate; LY 03005 hydrochloride dihydrate; LY-03005 hydrochloride dihydrate
IUPAC/Chemical Name
Benzoic acid, 4-methyl-, 4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenyl ester, hydrochloride, hydrate (1:1:2)
InChi Key
KNUFVVBEPJZGLI-UHFFFAOYSA-N
InChi Code
InChI=1S/C24H31NO3.ClH.2H2O/c1-18-7-9-20(10-8-18)23(26)28-21-13-11-19(12-14-21)22(17-25(2)3)24(27)15-5-4-6-16-24;;;/h7-14,22,27H,4-6,15-17H2,1-3H3;1H;2*1H2
SMILES Code
O=C(OC1=CC=C(C(C2(O)CCCCC2)CN(C)C)C=C1)C3=CC=C(C)C=C3.[H]Cl.[H]O[H].[H]O[H]
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 454.00 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Guo W, Gao Y, Jiang W, Li C, Lin F, Zhu H, Wang H, Ye L, Qi JG, Cen X, Tian J. Toxicity effects of a novel potent triple reuptake inhibitor, LPM570065, on the fertility and early embryonic development in Sprague-Dawley rats. Regul Toxicol Pharmacol. 2018 Dec;100:45-51. doi: 10.1016/j.yrtph.2018.10.008. Epub 2018 Oct 23. PubMed PMID: 30359699. 2: Li C, Jiang W, Gao Y, Lin F, Zhu H, Wang H, Ye L, Qi JG, Tian J. Acute, subchronic oral toxicity, and genotoxicity evaluations of LPM570065, a new potent triple reuptake inhibitor. Regul Toxicol Pharmacol. 2018 Oct;98:129-139. doi: 10.1016/j.yrtph.2018.07.011. Epub 2018 Jul 17. PubMed PMID: 30030102. 3: Zhang R, Li X, Shi Y, Shao Y, Sun K, Wang A, Sun F, Liu W, Wang D, Jin J, Li Y. The effects of LPM570065, a novel triple reuptake inhibitor, on extracellular serotonin, dopamine and norepinephrine levels in rats. PLoS One. 2014 Mar 10;9(3):e91775. doi: 10.1371/journal.pone.0091775. eCollection 2014. PubMed PMID: 24614602; PubMed Central PMCID: PMC3948889. 4: Fasipe OJ. The emergence of new antidepressants for clinical use: Agomelatine paradox versus other novel agents. IBRO Rep. 2019 Jan 9;6:95-110. doi: 10.1016/j.ibror.2019.01.001. eCollection 2019 Jun. Review. PubMed PMID: 31211282; PubMed Central PMCID: PMC6562183.